C9H14ClN3 — CID 103445669
1-(3-chloro-2-pyridinyl)butylhydrazine (PubChem CID 103445669) has the molecular formula C9H14ClN3 and a molecular weight of 199.69 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)butylhydrazine.
| Compound Name | 1-(3-chloro-2-pyridinyl)butylhydrazine |
|---|---|
| PubChem CID | 103445669 |
| Molecular Formula | C9H14ClN3 |
| Molecular Weight | 199.69 g/mol |
| Exact Mass | 199.09 |
| IUPAC Name | 1-(3-chloro-2-pyridinyl)butylhydrazine |
| SMILES | CCCC(NN)c1ncccc1Cl |
| InChI | InChI=1S/C9H14ClN3/c1-2-4-8(13-11)9-7(10)5-3-6-12-9/h3,5-6,8,13H,2,4,11H2,1H3 |
| InChIKey | JKVPVEUPGRSQKH-UHFFFAOYSA-N |
| XLogP | 2.04 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 199.69 |
| LogP ≤ 5 | 2.04 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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