N-Phenylpropanamide
PubChem CID: 12107
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| Compound Synonyms | N-Phenylpropanamide, N-Phenylpropionamide, 620-71-3, PROPIONANILIDE, Propanamide, N-phenyl-, Propionamide, N-phenyl-, NSC 58952, UNII-UYP5ZQI00T, UYP5ZQI00T, EINECS 210-649-3, BRN 2207039, R 50977, NSC-58952, DTXSID0060721, ZTHRQJQJODGZHV-UHFFFAOYSA-, 4-12-00-00385 (Beilstein Handbook Reference), N-PHENYLPROPANAMIDE [NFLIS-DRUG], FENTANYL IMPURITY G [EP IMPURITY], R-50977, REMIFENTANIL HYDROCHLORIDE IMPURITY O [EP IMPURITY], N-PHENYLPROPANAMIDE (NFLIS-DRUG), FENTANYL IMPURITY G (EP IMPURITY), N-phenyl-propionamide, REMIFENTANIL HYDROCHLORIDE IMPURITY O (EP IMPURITY), Methylacetanilid, Fentanyl Imp. G (EP), N-Phenylpropanamide, Fentanyl Impurity G, Remifentanil Hydrochloride Impurity O, Remifentanil Impurity O, Remifentanil Impurity O, N-Phenylpropanamide #, CH3CH2CONHPh, WLN: ZVMR, SCHEMBL9706, MLS001076193, CHEMBL1870645, DTXCID1043207, SCHEMBL11880444, HMS2269F06, NSC58952, MFCD00092530, STK060543, AKOS000492800, FP26998, NCGC00247442-01, AS-57336, SMR000639131, DB-054050, A8585, NS00034902, E79449, EN300-218949, Propionanilide, N-Phenylpropionamide, NSC 58952, Q26840807 |
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| Topological Polar Surface Area | 29.1 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 128.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | O75496, Q9NUW8, Q13148 |
| Iupac Name | N-phenylpropanamide |
| Prediction Hob | 1.0 |
| Xlogp | 1.6 |
| Molecular Formula | C9H11NO |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZTHRQJQJODGZHV-UHFFFAOYSA-N |
| Fcsp3 | 0.2222222222222222 |
| Logs | -2.029 |
| Rotatable Bond Count | 2.0 |
| Logd | 1.612 |
| Compound Name | N-Phenylpropanamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 149.084 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 149.084 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 149.19 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.359632963636364 |
| Inchi | InChI=1S/C9H11NO/c1-2-9(11)10-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,10,11) |
| Smiles | CCC(=O)NC1=CC=CC=C1 |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Rosa Transmorrisonensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all