Piperine
PubChem CID: 638024
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| Compound Synonyms | piperine, 94-62-2, 1-Piperoylpiperidine, Piperin, Bioperine, 7780-20-3, Piperoylpiperidine, FEMA No. 2909, (E,E)-1-piperoylpiperidine, Piperidine, 1-piperoyl-, (E,E)-, CCRIS 5572, 1-Piperoylpiperidine, (E,E)-, piperidine, 1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]-, (2E,4E)-5-(benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, AI 3-01439, EINECS 202-348-0, UNII-U71XL721QK, NSC 21727, NSC-21727, Piperine [USP], N-(E,E)-piperoyl-piperidine, (2E,4E)-5-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, U71XL721QK, N-[(E,E)-Piperoyl]piperidine, 1-Piperoyl-piperidine, DTXSID3021805, CHEBI:28821, (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one, MFCD00005839, 1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoyl]piperidine, 1,3-Benzodioxol-5-yl-1-oxo-2,4-pentadienyl-piperine, CHEMBL43185, Piperidine, 1-(5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-, (E,E)-, DTXCID701805, 1-(5-(1,3-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, (E,E)-, NSC21727, Piperine (USP), Piperidine, 1-(5-(3,4-methylenedioxyphenyl)-1-oxo-2,4-pentadienyl)-, PIPERINE (USP-RS), PIPERINE [USP-RS], 1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]piperidine, Piperidine, 1-((2E,4E)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)-, Piperidine, 1-[5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]-, (E,E)-, N-((E,E)-Piperoyl)piperidine, 1-[(2E,4E)-5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoyl]piperidine, (E,E)-1-(5-(1,3-BENZODIOXOL-5-YL)-2,4-PENTADIENOYL)PIPERIDINE, 5-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, SMR000112278, Piperine (aliphatic), SR-01000638580, Piperidine, 1-piperoyl-, Bioperine, 1-Piperoylpiperidine, 1-((2E,4E)-5-(1,3-benzodioxol-5-yl)-2,4-pentadienoyl)piperidine, 1-((2E,4E)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoyl)piperidine, 1-((2E,4E)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, CAS-94-62-2, Piperine,(S), 1-Piperylpiperidine, Prestwick_398, Piperine1537, Piperine (Standard), NSC 242267, Piperine, >=97%, ST079380, starbld0008505, Piperidine, (E,E)-, PIPERINE [FHFI], AI3-01439, PIPERINE [MI], Prestwick2_000474, Prestwick3_000474, Spectrum5_001507, PIPERINE [WHO-DD], Piperine, >=97%, FG, SCHEMBL94058, SCHEMBL94059, BSPBio_000608, BSPBio_002515, Piperine, analytical standard, MLS002153830, MLS002473213, BIDD:ER0675, SPECTRUM1500873, BPBio1_000670, GTPL2489, N-EE-PIPEROYL-PIPERIDINE, Piperine (1-Piperoylpiperidine), CHEBI:93043, FEMA 2909, HMS502P16, HY-N0144R, N-[(E,E)-piperoyl]-piperidine, HMS1569O10, HMS1921M12, HMS2092M22, HMS2096O10, HMS2270M18, Pharmakon1600-01500873, 1-trans,trans-piperinoyl-piperidine, BCP18901, HY-N0144, Tox21_201990, Tox21_302746, ((1-5-(1,3)-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, (1-(5-(1,3)-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, 1-(5-(3,4-Methylenedioxyphenyl)-1-oxo-2,4-pentadienyl)piperidine, 1-PIPEROYL-(E,E)-PIPERIDINE, BBL027541, BDBM50148573, CCG-39991, NSC757803, s2344, STL377909, (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(1-piperidyl)penta-2,4-dien-1-one, AKOS003369047, AKOS040750229, CS-6155, DB12582, FP27074, NSC-757803, SDCCGMLS-0066693.P001, IDI1_000954, (piperidin-1-yl)penta-2,4-dien-1-one, NCGC00094872-01, NCGC00094872-02, NCGC00094872-03, NCGC00094872-04, NCGC00094872-05, NCGC00094872-06, NCGC00094872-09, NCGC00094872-17, NCGC00256392-01, NCGC00259539-01, AC-11746, AS-17442, LS-14576, SBI-0051621.P002, CS-0368434, NS00009248, P0460, SW196642-2, EN300-20100, PIPERINE (CONSTITUENT OF BLACK PEPPER), C03882, AB00052185_08, EN300-7392817, AG-205/01792022, Q414501, (2E,4E)-5-(benzo[d][1,3]dioxol-5-yl)-1-, SR-01000638580-1, SR-01000638580-2, SR-01000638580-5, SR-01000638580-6, BRD-K59522102-001-08-8, BRD-K59522102-001-13-8, BRD-K59522102-001-14-6, BRD-K59522102-001-15-3, PIPERINE (CONSTITUENT OF BLACK PEPPER) [DSC], Q27164772, 1,3-Benzodioxol-5-yl-1-oxo-2,4-pentadienyl-piperidine, Piperine, European Pharmacopoeia (EP) Reference Standard, Z104476830, 1-[5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoyl]piperidine, (E,E)-5-(3,4-Methylenedioxyphenyl)-2,4-pentadienoylpiperidide, Piperine, United States Pharmacopeia (USP) Reference Standard, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-1-penta-2,4-dienone, 5-(1,3-dioxaindan-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, Piperidine,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]-, (E,E)-, (E,E) 1-[5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]piperidine, 1-[(2E,4E)-5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoyl]piperidine #, (2E,4E)-5-(1,3-dioxaindan-5-yl)-1-(piperidin-1-yl)penta-2,4-dien-1-one, (2E,4E)-5-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2 ,4-pentadien-1-one, (E,E)-1-[5-(1,3-Benzodioxol-5-yl)-2 ,4-pentadienoyl]piperidi ne, 1-Piperoylpiperidine, 147030-08-8, 202-348-0, InChI=1/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 38.8 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | CC(CCCCC1CCC2CCCC2C1)C1CCCCC1 |
| Np Classifier Class | Piperidine alkaloids |
| Deep Smiles | O=CNCCCCC6))))))/C=C/C=C/cccccc6)OCO5 |
| Heavy Atom Count | 21.0 |
| Description | Constituent of pepper (Piper nigrum) (Piperaceae). Isopiperine is found in herbs and spices and pepper (spice). |
| Scaffold Graph Node Level | OC(CCCCC1CCC2OCOC2C1)N1CCCCC1 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 412.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P28593, P0A0J7, P21396, P19643, Q64133, Q8BW75, Q8NER1, Q99714, B2RXH2, P51151, Q16637, P51450, P00352, Q962Y6, P28482, P00811, O15118, P15428, P08684, Q16236, Q96QE3, P19793, Q9UNA4, Q96RI1, P04150, P37231, P08659, P08183, P35869, P17405, Q99700, P38398, Q9R1A7, O42275, P81908, P02769, P27338, P21397, P07339, Q9NUW8, Q9Y6L6, Q9NPD5, P18507, A0A0C5K5S3, P04798, n.a., P09917, P0DTD1, P10275, Q03181 |
| Iupac Name | (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one |
| Prediction Hob | 1.0 |
| Veber Rule | True |
| Classyfire Superclass | Alkaloids and derivatives |
| Target Id | NPT472, NPT149, NPT48, NPT537, NPT93, NPT94, NPT282, NPT538, NPT151, NPT109, NPT668, NPT582, NPT261, NPT1547, NPT570 |
| Xlogp | 3.5 |
| Superclass | Alkaloids and derivatives |
| Gsk 4 400 Rule | True |
| Molecular Formula | C17H19NO3 |
| Scaffold Graph Node Bond Level | O=C(C=CC=Cc1ccc2c(c1)OCO2)N1CCCCC1 |
| Prediction Swissadme | 1.0 |
| Inchi Key | MXXWOMGUGJBKIW-YPCIICBESA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 0.3529411764705882 |
| Logs | -4.324 |
| Rotatable Bond Count | 3.0 |
| State | Solid |
| Logd | 3.446 |
| Synonyms | 1-[(2e,4e)-5-(1,3-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]piperidine, 1-[(2e,4e)-5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoyl]piperidine, 1-Piperoyl-(e,e)-piperidine, 1-Piperoyl-piperidine, 1-Piperoylpiperidine, Isopiperine, Isochavicine, Chavicine, (E,E)-1-piperoylpiperidine, 1-Piperoylpiperidine, (E,E)-, FEMA 2909, N-(e,e)-piperoyl-piperidine, N-[(e,e)-piperoyl]piperidine, N-ee-piperoyl-piperidine, Piperidine, 1-piperoyl-, (E,E)-, Piperin, Piperine, (e,e)-1-Piperoylpiperidine, 1-[(2E,4E)-5-(1,3-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]piperidine, 1-[(2E,4E)-5-(1,3-Benzodioxol-5-yl)-2,4-pentadienoyl]piperidine, N-[(e,e)-Piperoyl]piperidine, Bioperine, N-(e,e)-Piperoyl-piperidine, N-Ee-piperoyl-piperidine, Piperine, (e,Z)-isomer, Piperine, (Z,e)-isomer, Piperine, (Z,Z)-isomer, ((1-5-(1,3)-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, (1-(5-(1,3)-Benzodioxol-5-yl)-1-oxo-2,4-pentadienyl)piperidine, Piperine, (e,e)-isomer, piperin, piperine |
| Substituent Name | Piperine, Alkaloid or derivatives, N-acyl-piperidine, Benzodioxole, Styrene, Benzenoid, Piperidine, Tertiary carboxylic acid amide, Tertiary amine, Carboxamide group, Oxacycle, Azacycle, Organoheterocyclic compound, Ether, Carboxylic acid derivative, Acetal, Hydrocarbon derivative, Organooxygen compound, Organonitrogen compound, Carbonyl group, Amine, Aromatic heteropolycyclic compound |
| Esol Class | Soluble |
| Functional Groups | c/C=C/C=C/C(=O)N(C)C, c1cOCO1 |
| Compound Name | Piperine |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 285.136 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 285.136 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 285.34 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 2.0 |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | -3.736355171428572 |
| Inchi | InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+ |
| Smiles | C1CCN(CC1)C(=O)/C=C/C=C/C2=CC3=C(C=C2)OCO3 |
| Nring | 3.0 |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 2.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Alkaloids and derivatives |
| Np Classifier Superclass | Lysine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Abies Webbiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Aframomum Melegueta (Plant) Rel Props:Reference:ISBN:9780387706375 - 3. Outgoing r'ship
FOUND_INto/from Anethum Graveolens (Plant) Rel Props:Source_db:fooddb_chem_all - 4. Outgoing r'ship
FOUND_INto/from Anethum Sowa (Plant) Rel Props:Reference:ISBN:9788172361150 - 5. Outgoing r'ship
FOUND_INto/from Artemisia Coerulescens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Brickellia Longifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Bupleurum Rigidum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Carpesium Longifolium (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Cochlearia Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Coelogyne Nitida (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 11. Outgoing r'ship
FOUND_INto/from Crocus Corsicus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Curcuma Longa (Plant) Rel Props:Reference:https://www.ncbi.nlm.nih.gov/pubmed/27529277 - 13. Outgoing r'ship
FOUND_INto/from Dichotomanthes Tristaniicarpa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 14. Outgoing r'ship
FOUND_INto/from Dracontium Loretense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Euphorbia Wangii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 16. Outgoing r'ship
FOUND_INto/from Frullania Brasiliensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 17. Outgoing r'ship
FOUND_INto/from Homalium Laurifolium (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 18. Outgoing r'ship
FOUND_INto/from Hydrastis Canadensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 19. Outgoing r'ship
FOUND_INto/from Magnolia Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 20. Outgoing r'ship
FOUND_INto/from Matsumurella Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 21. Outgoing r'ship
FOUND_INto/from Palisota Barteri (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 22. Outgoing r'ship
FOUND_INto/from Pentanema Indicum (Plant) Rel Props:Reference:ISBN:9788185042145 - 23. Outgoing r'ship
FOUND_INto/from Piper Argyrophyllum (Plant) Rel Props:Reference:ISBN:9788185042138 - 24. Outgoing r'ship
FOUND_INto/from Piper Attenuatum (Plant) Rel Props:Reference:ISBN:9780387706375 - 25. Outgoing r'ship
FOUND_INto/from Piper Bantamense (Plant) Rel Props:Reference:ISBN:9788172362461 - 26. Outgoing r'ship
FOUND_INto/from Piper Betle (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 27. Outgoing r'ship
FOUND_INto/from Piper Cubeba (Plant) Rel Props:Reference:ISBN:9788172363130 - 28. Outgoing r'ship
FOUND_INto/from Piper Guineense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 29. Outgoing r'ship
FOUND_INto/from Piper Longum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 30. Outgoing r'ship
FOUND_INto/from Piper Nigrum (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 31. Outgoing r'ship
FOUND_INto/from Piper Peepuloides (Plant) Rel Props:Reference:ISBN:9788185042084 - 32. Outgoing r'ship
FOUND_INto/from Piper Retrofractum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 33. Outgoing r'ship
FOUND_INto/from Piper Sylvaticum (Plant) Rel Props:Reference:ISBN:9780387706375; ISBN:9788185042084 - 34. Outgoing r'ship
FOUND_INto/from Piper Trioicum (Plant) Rel Props:Reference:ISBN:9788185042114 - 35. Outgoing r'ship
FOUND_INto/from Piper Wallichii (Plant) Rel Props:Reference:ISBN:9780387706375; ISBN:9788172362461; ISBN:9788185042084 - 36. Outgoing r'ship
FOUND_INto/from Podocarpus Minor (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 37. Outgoing r'ship
FOUND_INto/from Rubia Cordifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 38. Outgoing r'ship
FOUND_INto/from Schefflera Venulosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 39. Outgoing r'ship
FOUND_INto/from Silene Banksia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 40. Outgoing r'ship
FOUND_INto/from Valeriana Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 41. Outgoing r'ship
FOUND_INto/from Verbesina Virginica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all