C9H17N5 — CID 105231052
4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine (PubChem CID 105231052) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine.
| Compound Name | 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine |
|---|---|
| PubChem CID | 105231052 |
| Molecular Formula | C9H17N5 |
| Molecular Weight | 195.27 g/mol |
| Exact Mass | 195.15 |
| IUPAC Name | 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine |
| SMILES | C=CCCCC(NN)c1cn[nH]c1N |
| InChI | InChI=1S/C9H17N5/c1-2-3-4-5-8(13-11)7-6-12-14-9(7)10/h2,6,8,13H,1,3-5,11H2,(H3,10,12,14) |
| InChIKey | ROFXNICLRBBYBT-UHFFFAOYSA-N |
| XLogP | 0.85 |
| TPSA | 92.75 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 195.27 |
| LogP ≤ 5 | 0.85 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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