C11H12N6O — CID 106897774
6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 106897774) has the molecular formula C11H12N6O and a molecular weight of 244.26 g/mol. Its IUPAC name is 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide.
| Compound Name | 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide |
|---|---|
| PubChem CID | 106897774 |
| Molecular Formula | C11H12N6O |
| Molecular Weight | 244.26 g/mol |
| Exact Mass | 244.11 |
| IUPAC Name | 6-hydrazinyl-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide |
| SMILES | NNc1cccc(C(=O)NCc2cccnn2)n1 |
| InChI | InChI=1S/C11H12N6O/c12-16-10-5-1-4-9(15-10)11(18)13-7-8-3-2-6-14-17-8/h1-6H,7,12H2,(H,13,18)(H,15,16) |
| InChIKey | BHLSGLUZOLMSKR-UHFFFAOYSA-N |
| XLogP | 0.09 |
| TPSA | 105.82 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 244.26 |
| LogP ≤ 5 | 0.09 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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