(NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine
Formula:C9H14N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine |
| MolecularFormula | C9H14N2O |
| Smiles | C=CC(CN1CC2)C2C/C1=N\O |
| InChI | InChI=1S/C9H14N2O/c1-2-7-6-11-4-3-8(7)5-9(11)10-12/h2,7-8,12H,1,3-6H2 |
| InChIK | NELURRSZUNZEMY-UHFFFAOYSA-N |
| TotalMolweight | 166.223 |
| Molweight | 166.223 |
| MonoisotopicMass | 166.110613 |
| CLogP | 1.7231 |
| CLogS | -1.765 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 130.7 |
| Relative PSA | 0.21546 |
| PolarSurfaceArea | 35.83 |
| Druglikeness | 0.54756 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 12 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 2 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 3 |
| Sp3Atoms | 7 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - (NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine | 2 - (NE)-N-(5-ethenyl-1-azabicyclo[2.2.2]octan-2-ylidene)hydroxylamine
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