(NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide
Formula:C12H20N4O2
Mutagenic:high
Tumorigenic:low
Reproductive Effective:none
(NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide is a drug-like molecule.
| MolName | (NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide |
| MolecularFormula | C12H20N4O2 |
| Smiles | O=C(N1CCCCC1)/N=N/C(N1CCCCC1)=O |
| InChI | InChI=1S/C12H20N4O2/c17-11(15-7-3-1-4-8-15)13-14-12(18)16-9-5-2-6-10-16/h1-10H2 |
| InChIK | OQJBFFCUFALWQL-UHFFFAOYSA-N |
| TotalMolweight | 252.317 |
| Molweight | 252.317 |
| MonoisotopicMass | 252.158626 |
| CLogP | 2.1218 |
| CLogS | -2.596 |
| H Acceptors | 6 |
| TotalSurfaceArea | 203.22 |
| Relative PSA | 0.27655 |
| PolarSurfaceArea | 65.34 |
| Druglikeness | -7.1648 |
| Mutagenic | high |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | azo |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 10 |
| Symmetricatoms | 11 |
| Amides | 2 |
| StereoCon |
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