(NE)-N-(2,3,6-triphenylpiperidin-4-ylidene)hydroxylamine
Formula:C23H22N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(2,3,6-triphenylpiperidin-4-ylidene)hydroxylamine is not a drug-like molecule.
| MolName | (NE)-N-(2,3,6-triphenylpiperidin-4-ylidene)hydroxylamine |
| MolecularFormula | C23H22N2O |
| Smiles | O/N=C(\CC(c1ccccc1)NC1c2ccccc2)/C1c1ccccc1 |
| InChI | InChI=1S/C23H22N2O/c26-25-21-16-20(17-10-4-1-5-11-17)24-23(19-14-8-3-9-15-19)22(21)18-12-6-2-7-13-18/h1-15,20,22-24,26H,16H2 |
| InChIK | QWMMGJJMBIYAMK-UHFFFAOYSA-N |
| TotalMolweight | 342.441 |
| Molweight | 342.441 |
| MonoisotopicMass | 342.173213 |
| CLogP | 5.4343 |
| CLogS | -4.573 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 271.32 |
| Relative PSA | 0.13294 |
| PolarSurfaceArea | 44.62 |
| Druglikeness | 0.4825 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46154 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 6 |
| Symmetricatoms | 6 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - (NE)-N-(2,3,6-triphenylpiperidin-4-ylidene)hydroxylamine | 2 - (NE)-N-(2,3,6-triphenylpiperidin-4-ylidene)hydroxylamine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off