N-[(Z)-cyclohexylmethylideneamino]-2-naphthalen-1-ylacetamide
Formula:C19H22N2O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-cyclohexylmethylideneamino]-2-naphthalen-1-ylacetamide is a drug-like molecule.
| MolName | N-[(Z)-cyclohexylmethylideneamino]-2-naphthalen-1-ylacetamide |
| MolecularFormula | C19H22N2O |
| Smiles | O=C(Cc1cccc2ccccc12)N/N=C\C1CCCCC1 |
| InChI | InChI=1S/C19H22N2O/c22-19(21-20-14-15-7-2-1-3-8-15)13-17-11-6-10-16-9-4-5-12-18(16)17/h4-6,9-12,14-15H,1-3,7-8,13H2,(H,21,22) |
| InChIK | YJKRFBBHJPVUEA-UHFFFAOYSA-N |
| TotalMolweight | 294.397 |
| Molweight | 294.397 |
| MonoisotopicMass | 294.173213 |
| CLogP | 3.9835 |
| CLogS | -5.37 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 243.39 |
| Relative PSA | 0.14795 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | -0.40101 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 7 |
| Symmetricatoms | 2 |
| StereoCon |
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