C13H15ClN4O — CID 103445839
[(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine (PubChem CID 103445839) has the molecular formula C13H15ClN4O and a molecular weight of 278.74 g/mol. Its IUPAC name is [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine.
| Compound Name | [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine |
|---|---|
| PubChem CID | 103445839 |
| Molecular Formula | C13H15ClN4O |
| Molecular Weight | 278.74 g/mol |
| Exact Mass | 278.09 |
| IUPAC Name | [(3-chloro-2-pyridinyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine |
| SMILES | CCOc1cncc(C(NN)c2ncccc2Cl)c1 |
| InChI | InChI=1S/C13H15ClN4O/c1-2-19-10-6-9(7-16-8-10)12(18-15)13-11(14)4-3-5-17-13/h3-8,12,18H,2,15H2,1H3 |
| InChIKey | UKYUOZZUZNMSMJ-UHFFFAOYSA-N |
| XLogP | 2.08 |
| TPSA | 73.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 278.74 |
| LogP ≤ 5 | 2.08 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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