C13H20N4O — CID 62247413
(3,5-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone (PubChem CID 62247413) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is (3,5-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone.
| Compound Name | (3,5-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone |
|---|---|
| PubChem CID | 62247413 |
| Molecular Formula | C13H20N4O |
| Molecular Weight | 248.33 g/mol |
| Exact Mass | 248.16 |
| IUPAC Name | (3,5-dimethylpiperidin-1-yl)-(6-hydrazinyl-3-pyridinyl)methanone |
| SMILES | CC1CC(C)CN(C(=O)c2ccc(NN)nc2)C1 |
| InChI | InChI=1S/C13H20N4O/c1-9-5-10(2)8-17(7-9)13(18)11-3-4-12(16-14)15-6-11/h3-4,6,9-10H,5,7-8,14H2,1-2H3,(H,15,16) |
| InChIKey | NUDPUYHQNUIHPI-UHFFFAOYSA-N |
| XLogP | 1.49 |
| TPSA | 71.25 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 248.33 |
| LogP ≤ 5 | 1.49 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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