C12H20N2OS — CID 105198543
[1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine (PubChem CID 105198543) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine.
| Compound Name | [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine |
|---|---|
| PubChem CID | 105198543 |
| Molecular Formula | C12H20N2OS |
| Molecular Weight | 240.37 g/mol |
| Exact Mass | 240.13 |
| IUPAC Name | [1-(oxolan-2-yl)-4-thiophen-2-ylbutan-2-yl]hydrazine |
| SMILES | NNC(CCc1cccs1)CC1CCCO1 |
| InChI | InChI=1S/C12H20N2OS/c13-14-10(9-11-3-1-7-15-11)5-6-12-4-2-8-16-12/h2,4,8,10-11,14H,1,3,5-7,9,13H2 |
| InChIKey | JGMLXTGPIWYIRF-UHFFFAOYSA-N |
| XLogP | 2.08 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 240.37 |
| LogP ≤ 5 | 2.08 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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