2-phenoxy-N-[(Z)-pyridin-4-ylmethylideneamino]acetamide
Formula:C14H13N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-phenoxy-N-[(Z)-pyridin-4-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-phenoxy-N-[(Z)-pyridin-4-ylmethylideneamino]acetamide |
| MolecularFormula | C14H13N3O2 |
| Smiles | O=C(COc1ccccc1)N/N=C\c1ccncc1 |
| InChI | InChI=1S/C14H13N3O2/c18-14(11-19-13-4-2-1-3-5-13)17-16-10-12-6-8-15-9-7-12/h1-10H,11H2,(H,17,18) |
| InChIK | PHMDAEZEBANTGH-UHFFFAOYSA-N |
| TotalMolweight | 255.276 |
| Molweight | 255.276 |
| MonoisotopicMass | 255.100777 |
| CLogP | 1.7756 |
| CLogS | -2.706 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 209.51 |
| Relative PSA | 0.27197 |
| PolarSurfaceArea | 63.58 |
| Druglikeness | 4.1966 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.73684 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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