N-[(Z)-benzylideneamino]-2-oxo-2-piperidin-1-ylacetamide
Formula:C14H17N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-2-oxo-2-piperidin-1-ylacetamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-2-oxo-2-piperidin-1-ylacetamide |
| MolecularFormula | C14H17N3O2 |
| Smiles | O=C(C(N1CCCCC1)=O)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C14H17N3O2/c18-13(14(19)17-9-5-2-6-10-17)16-15-11-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H,16,18) |
| InChIK | AXBMOOUJKDXJSF-UHFFFAOYSA-N |
| TotalMolweight | 259.308 |
| Molweight | 259.308 |
| MonoisotopicMass | 259.132077 |
| CLogP | 1.8347 |
| CLogS | -2.612 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 210.58 |
| Relative PSA | 0.24979 |
| PolarSurfaceArea | 61.77 |
| Druglikeness | 3.5439 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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