N-[(Z)-benzylideneamino]-2-phenylcyclopropane-1-carboxamide
Formula:C17H16N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-2-phenylcyclopropane-1-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-2-phenylcyclopropane-1-carboxamide |
| MolecularFormula | C17H16N2O |
| Smiles | O=C(C(C1)C1c1ccccc1)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C17H16N2O/c20-17(19-18-12-13-7-3-1-4-8-13)16-11-15(16)14-9-5-2-6-10-14/h1-10,12,15-16H,11H2,(H,19,20) |
| InChIK | OGGKFAULSBCNTR-UHFFFAOYSA-N |
| TotalMolweight | 264.327 |
| Molweight | 264.327 |
| MonoisotopicMass | 264.126263 |
| CLogP | 3.8203 |
| CLogS | -4.3 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 212.25 |
| Relative PSA | 0.16966 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 5.6169 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon | unknown chirality |
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