2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(cyclohexen-1-yl)ethyl]acetamide
Formula:C18H23N3O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(cyclohexen-1-yl)ethyl]acetamide is a drug-like molecule.
| MolName | 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(cyclohexen-1-yl)ethyl]acetamide |
| MolecularFormula | C18H23N3O3 |
| Smiles | O=C(CO/N=C\C(Nc1ccccc1)=O)NCCC1=CCCCC1 |
| InChI | InChI=1S/C18H23N3O3/c22-17(21-16-9-5-2-6-10-16)13-20-24-14-18(23)19-12-11-15-7-3-1-4-8-15/h2,5-7,9-10,13H,1,3-4,8,11-12,14H2,(H,19,23)(H,21,22) |
| InChIK | VELNWCBDFOYKDW-UHFFFAOYSA-N |
| TotalMolweight | 329.399 |
| Molweight | 329.399 |
| MonoisotopicMass | 329.173942 |
| CLogP | 2.233 |
| CLogS | -3.444 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 273.97 |
| Relative PSA | 0.25736 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | -2.77 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.75 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 8 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(cyclohexen-1-yl)ethyl]acetamide | 2 - 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(cyclohexen-1-yl)ethyl]acetamide
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