2-phenyl-N-[4-[(2-phenylacetyl)amino]butyl]acetamide
PubChem CID: 2162324
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| Compound Synonyms | Aglaiduline, 2-phenyl-N-[4-[(2-phenylacetyl)amino]butyl]acetamide, CHEMBL2314223, SCHEMBL10585628, STK429212, AKOS003243716, N,N'-butane-1,4-diylbis(2-phenylacetamide), SR-01000205191, SR-01000205191-1 |
|---|---|
| Topological Polar Surface Area | 58.2 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 336.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-phenyl-N-[4-[(2-phenylacetyl)amino]butyl]acetamide |
| Prediction Hob | 0.0 |
| Xlogp | 2.8 |
| Molecular Formula | C20H24N2O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | GYLIXRZGMBZSMD-UHFFFAOYSA-N |
| Fcsp3 | 0.3 |
| Logs | -2.677 |
| Rotatable Bond Count | 9.0 |
| Logd | 2.417 |
| Compound Name | 2-phenyl-N-[4-[(2-phenylacetyl)amino]butyl]acetamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 324.184 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 324.184 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 324.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.8198288 |
| Inchi | InChI=1S/C20H24N2O2/c23-19(15-17-9-3-1-4-10-17)21-13-7-8-14-22-20(24)16-18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16H2,(H,21,23)(H,22,24) |
| Smiles | C1=CC=C(C=C1)CC(=O)NCCCCNC(=O)CC2=CC=CC=C2 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aglaia Edulis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all