2-phenyl-N-[(E)-2-phenylethenyl]acetamide
Formula:C16H15NO
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-phenyl-N-[(E)-2-phenylethenyl]acetamide is a drug-like molecule.
| MolName | 2-phenyl-N-[(E)-2-phenylethenyl]acetamide |
| MolecularFormula | C16H15NO |
| Smiles | O=C(Cc1ccccc1)N/C=C/c1ccccc1 |
| InChI | InChI=1S/C16H15NO/c18-16(13-15-9-5-2-6-10-15)17-12-11-14-7-3-1-4-8-14/h1-12H,13H2,(H,17,18) |
| InChIK | HQVAGQCFMKBYDN-UHFFFAOYSA-N |
| TotalMolweight | 237.301 |
| Molweight | 237.301 |
| MonoisotopicMass | 237.115364 |
| CLogP | 2.8272 |
| CLogS | -3.608 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 202.49 |
| Relative PSA | 0.12099 |
| PolarSurfaceArea | 29.1 |
| Druglikeness | 1.0734 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72222 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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