C13H22N2OS — CID 105277015
[(1-methoxy-4-methylcyclohexyl)-thiophen-3-ylmethyl]hydrazine (PubChem CID 105277015) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is [(1-methoxy-4-methylcyclohexyl)-thiophen-3-ylmethyl]hydrazine.
| Compound Name | [(1-methoxy-4-methylcyclohexyl)-thiophen-3-ylmethyl]hydrazine |
|---|---|
| PubChem CID | 105277015 |
| Molecular Formula | C13H22N2OS |
| Molecular Weight | 254.40 g/mol |
| Exact Mass | 254.15 |
| IUPAC Name | [(1-methoxy-4-methylcyclohexyl)-thiophen-3-ylmethyl]hydrazine |
| SMILES | COC1(C(NN)c2ccsc2)CCC(C)CC1 |
| InChI | InChI=1S/C13H22N2OS/c1-10-3-6-13(16-2,7-4-10)12(15-14)11-5-8-17-9-11/h5,8-10,12,15H,3-4,6-7,14H2,1-2H3 |
| InChIKey | OIZVNZXGDXQYHN-UHFFFAOYSA-N |
| XLogP | 2.85 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 254.40 |
| LogP ≤ 5 | 2.85 |
| 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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