Propylamine
PubChem CID: 7852
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| Compound Synonyms | Propylamine, Propan-1-amine, 107-10-8, 1-Propanamine, 1-Propylamine, n-Propylamine, Propanamine, 1-AMINOPROPANE, Mono-n-propylamine, Monopropylamine, RCRA waste number U194, n-Propyl Amine, Propan-1-ylamine, NSC 7490, (n-Propan-1-yl)amine, HSDB 5162, 3-Aminopropane, n-C3H7NH2, EINECS 203-462-3, UNII-I76F18D635, CHEBI:39870, AI3-26456, NSC-7490, MFCD00008205, I76F18D635, DTXSID6021878, FEMA NO. 4237, EC 203-462-3, propane, 1-amino-, propyl amine, 58479-39-3, 3-AMINOPROPYL, UN1277, RCRA waste no. U194, aminopropane, n-propyl-amine, 3-propylamine, N-n-propylamine, propane-1-amine, 2-methylethylamine, n-prop-1-ylamine, Propanamine, 9CI, Propylamine, 98%, PrNH2, Propylamine, >=99%, Propylamine [UN1277] [Flammable liquid], PROPYLAMINE [MI], 3-Aminopropyl Silica Gel, PROPYLAMINE [FHFI], NH2CH2CH2CH3, C3H9N, WLN: Z3, CHEMBL14409, 1-AMINOPROPANE [HSDB], DTXCID001878, Propylamine, analytical standard, NSC7490, BCP18818, STR01427, STL185558, AKOS000120278, FP63337, UN 1277, Propylamine, purum, >=99.0% (GC), DB-002025, A2140, NS00002355, P0520, PROPYLAMINE (NORMAL) (N-PROPYLAMINE), Propylamine [UN1277] [Flammable liquid], EN300-20505, InChI=1/C3H9N/c1-2-3-4/h2-4H2,1H, A801584, Q417852, F2190-0357, 203-462-3 |
|---|---|
| Topological Polar Surface Area | 26.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 4.0 |
| Description | Isolated from vegetable sources. 1-Propylamine is found in many foods, some of which are green bell pepper, orange bell pepper, pepper (c. annuum), and wild celery. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 7.2 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | propan-1-amine |
| Prediction Hob | 1.0 |
| Class | Amines |
| Xlogp | 0.5 |
| Superclass | Organonitrogen compounds |
| Subclass | Primary amines |
| Molecular Formula | C3H9N |
| Prediction Swissadme | 0.0 |
| Inchi Key | WGYKZJWCGVVSQN-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 1.0 |
| State | Liquid |
| Synonyms | (C10-C16) Alkylalkoxypropyleneamine, (C10-C16)Alkylalkoxypropyleneamine, (C12-C18) Alkylalkoxypropyleneamine, (C12-C18)Alkyl alkoxypropylene amine, (C14-C18)Alkylalkoxypropyleneamine, (C16-C22)Alkyl alkoxypropyleneamine, (C6-C12) Alkylalkoxypropyleneamine, (C6-C12)Alkylalkoxypropyleneamine, 1-Aminopropane, 1-Propanamine, 1-Propanamine, 3-(C10-16-alkyloxy) derivs., 1-Propanamine, 3-(C12-18-alkyloxy) derivs., 1-Propanamine, 3-(C14-18-alkyloxy) derivs., 1-Propanamine, 3-(C16-22-alkyloxy) derivs., 1-Propanamine, 3-(C6-12-alkyloxy) derivs., 3-AMINOPROPYL, AYE, Mono-n-propylamine, Monopropylamine, n-C3H7NH2, N-propyl amine, N-propylamine, propan-1-amine, Propanamine, Propanamine, 9CI, Propyl amines, Propylamine, Propylamine [UN1277] [Flammable liquid], mono-N-Propylamine, N-Propylamine, N-C3H7NH2, N-Propyl amine, Propan-1-amine, Propanamine, 9ci, 1-Propylamine |
| Substituent Name | Hydrocarbon derivative, Primary aliphatic amine, Aliphatic acyclic compound |
| Compound Name | Propylamine |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 59.0735 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 59.0735 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 59.11 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Esol | -0.44914399999999993 |
| Inchi | InChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3 |
| Smiles | CCCN |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Monoalkylamines |
- 1. Outgoing r'ship
FOUND_INto/from Apium Graveolens (Plant) Rel Props:Source_db:fooddb_chem_all - 2. Outgoing r'ship
FOUND_INto/from Astragalus Oxyphysus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Capsicum Annuum (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Centaurea Glastifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Citrus Japonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Croomia Japonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Cuscuta Reflexa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Eupatorium Glehni (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Euphorbia Armena (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Galanthus Nivalis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 11. Outgoing r'ship
FOUND_INto/from Grindelia Havardii (Plant) Rel Props:Source_db:npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Hydrodictyon Reticulatum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 13. Outgoing r'ship
FOUND_INto/from Nephelium Maingayi (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 14. Outgoing r'ship
FOUND_INto/from Phyllanthus Muellerianus (Plant) Rel Props:Source_db:npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Plantago Depressa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 16. Outgoing r'ship
FOUND_INto/from Polyscias Scutellaria (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 17. Outgoing r'ship
FOUND_INto/from Prunus Dulcis (Plant) Rel Props:Source_db:npass_chem_all - 18. Outgoing r'ship
FOUND_INto/from Pyrus Pyraster (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 19. Outgoing r'ship
FOUND_INto/from Senecio Candollei (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 20. Outgoing r'ship
FOUND_INto/from Uncaria Nervosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 21. Outgoing r'ship
FOUND_INto/from Vitis Vinifera (Plant) Rel Props:Source_db:fooddb_chem_all