N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]pyridin-2-amine
Formula:C16H18N4O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]pyridin-2-amine is a drug-like molecule.
| MolName | N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]pyridin-2-amine |
| MolecularFormula | C16H18N4O |
| Smiles | C(COCC1)N1c1ccc(/C=N\Nc2ncccc2)cc1 |
| InChI | InChI=1S/C16H18N4O/c1-2-8-17-16(3-1)19-18-13-14-4-6-15(7-5-14)20-9-11-21-12-10-20/h1-8,13H,9-12H2,(H,17,19) |
| InChIK | LMSMWGSECLCPJM-UHFFFAOYSA-N |
| TotalMolweight | 282.346 |
| Molweight | 282.346 |
| MonoisotopicMass | 282.148061 |
| CLogP | 3.8604 |
| CLogS | -2.982 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 229.84 |
| Relative PSA | 0.20662 |
| PolarSurfaceArea | 49.75 |
| Druglikeness | 3.2985 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]pyridin-2-amine | 2 - N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]pyridin-2-amine
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