Tetrahydropiperine
PubChem CID: 581676
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| Compound Synonyms | Tetrahydropiperine, 23434-88-0, Tetrahydropiperidine, Cosmoperine, Tetrahydropiperin, 1-Pentanone, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, 5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpentan-1-one, 5-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)pentan-1-one, UNII-8904DO502T, 8904DO502T, CHEMBL332479, Piperidine, 1-(5-(1,3-benzodioxol-5-yl)-1-oxopentyl)-, Piperidine, 1-(5-(3,4-(methylenedioxy)phenyl)valeryl)-, DTXSID00177988, 5-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-1-pentanone, Piperidine, 1-[5-(1,3-benzodioxol-5-yl)-1-oxopentyl]-, 5-(3,4-Methylenedioxyphenyl) Pentanoicacid Piperidine Amide, SCHEMBL4898699, TETRAHYDROPIPERINE [INCI], DTXCID60100479, CHEBI:184110, HMS3886A15, HY-N4205, YAA43488, BDBM50381233, MFCD17167032, MSK175423, s5154, XH1542, AKOS030631903, CCG-267372, AC-34775, BS-51886, DA-78353, CS-0032425, NS00027417, E77130, 5-(3,4-methylenedioxyphenyl)-pentanoylpiperidine, 1-[5-(1,3-Benzodioxol-5-yl)pentanoyl]piperidine #, Q27269974, TetrahydropiperinTetrahydropiperidine, Tetrahydropiperin, 5-(2H-1,3-BENZODIOXOL-5-YL)-1-(PIPERIDIN-1-YL)PENTAN-1-ONE, 927-574-3 |
|---|---|
| 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))))))CCCCcccccc6)OCO5 |
| Heavy Atom Count | 21.0 |
| Classyfire Class | Benzodioxoles |
| Scaffold Graph Node Level | OC(CCCCC1CCC2OCOC2C1)N1CCCCC1 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 341.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpentan-1-one |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Xlogp | 3.2 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C17H23NO3 |
| Scaffold Graph Node Bond Level | O=C(CCCCc1ccc2c(c1)OCO2)N1CCCCC1 |
| Inchi Key | APZYKUZPJCQGPP-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Rotatable Bond Count | 5.0 |
| Synonyms | tetrahydropiperine |
| Esol Class | Soluble |
| Functional Groups | CC(=O)N(C)C, c1cOCO1 |
| Compound Name | Tetrahydropiperine |
| Exact Mass | 289.168 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 289.168 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 289.4 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C17H23NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h8-9,12H,1-7,10-11,13H2 |
| Smiles | C1CCN(CC1)C(=O)CCCCC2=CC3=C(C=C2)OCO3 |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Lysine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Piper Longum (Plant) Rel Props:Reference:ISBN:9788172363130