N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclohexanecarboxamide
Formula:C14H20N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclohexanecarboxamide is a drug-like molecule.
| MolName | N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclohexanecarboxamide |
| MolecularFormula | C14H20N2O |
| Smiles | O=C(C1CCCCC1)N/N=C(/C1)\C2C1C=CC2 |
| InChI | InChI=1S/C14H20N2O/c17-14(10-5-2-1-3-6-10)16-15-13-9-11-7-4-8-12(11)13/h4,7,10-12H,1-3,5-6,8-9H2,(H,16,17) |
| InChIK | CSKUPJIJZIEQBV-UHFFFAOYSA-N |
| TotalMolweight | 232.326 |
| Molweight | 232.326 |
| MonoisotopicMass | 232.157563 |
| CLogP | 2.4806 |
| CLogS | -3.647 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 185.5 |
| Relative PSA | 0.19412 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | -2.0561 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 2 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 4 |
| Sp3Atoms | 10 |
| Symmetricatoms | 2 |
| StereoCon | unknown chirality |
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