C7H11ClN4O — CID 130616634
2-(2-amino-3-pyridinyl)acetohydrazide;hydrochloride (PubChem CID 130616634) has the molecular formula C7H11ClN4O and a molecular weight of 202.65 g/mol. Its IUPAC name is 2-(2-amino-3-pyridinyl)acetohydrazide;hydrochloride.
| Compound Name | 2-(2-amino-3-pyridinyl)acetohydrazide;hydrochloride |
|---|---|
| PubChem CID | 130616634 |
| Molecular Formula | C7H11ClN4O |
| Molecular Weight | 202.65 g/mol |
| Exact Mass | 202.06 |
| IUPAC Name | 2-(2-amino-3-pyridinyl)acetohydrazide;hydrochloride |
| SMILES | Cl.NNC(=O)Cc1cccnc1N |
| InChI | InChI=1S/C7H10N4O.ClH/c8-7-5(2-1-3-10-7)4-6(12)11-9;/h1-3H,4,9H2,(H2,8,10)(H,11,12);1H |
| InChIKey | MKZFKWVIUBKTHZ-UHFFFAOYSA-N |
| XLogP | -0.38 |
| TPSA | 94.03 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 202.65 |
| LogP ≤ 5 | -0.38 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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