N-[(Z)-2-bicyclo[2.2.1]heptanylideneamino]cyclohexanecarboxamide
Formula:C14H22N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-2-bicyclo[2.2.1]heptanylideneamino]cyclohexanecarboxamide is a drug-like molecule.
| MolName | N-[(Z)-2-bicyclo[2.2.1]heptanylideneamino]cyclohexanecarboxamide |
| MolecularFormula | C14H22N2O |
| Smiles | O=C(C1CCCCC1)N/N=C1\C(CC2)CC2C1 |
| InChI | InChI=1S/C14H22N2O/c17-14(11-4-2-1-3-5-11)16-15-13-9-10-6-7-12(13)8-10/h10-12H,1-9H2,(H,16,17) |
| InChIK | CDAQUQHUPZQMMR-UHFFFAOYSA-N |
| TotalMolweight | 234.342 |
| Molweight | 234.342 |
| MonoisotopicMass | 234.173213 |
| CLogP | 2.756 |
| CLogS | -3.875 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 186.52 |
| Relative PSA | 0.19306 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | -0.73929 |
| 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 | 12 |
| Symmetricatoms | 2 |
| StereoCon | unknown chirality |
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