C16H22N2S — CID 105340477
[(3-ethylthiophen-2-yl)-(3-propylphenyl)methyl]hydrazine (PubChem CID 105340477) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is [(3-ethylthiophen-2-yl)-(3-propylphenyl)methyl]hydrazine.
| Compound Name | [(3-ethylthiophen-2-yl)-(3-propylphenyl)methyl]hydrazine |
|---|---|
| PubChem CID | 105340477 |
| Molecular Formula | C16H22N2S |
| Molecular Weight | 274.43 g/mol |
| Exact Mass | 274.15 |
| IUPAC Name | [(3-ethylthiophen-2-yl)-(3-propylphenyl)methyl]hydrazine |
| SMILES | CCCc1cccc(C(NN)c2sccc2CC)c1 |
| InChI | InChI=1S/C16H22N2S/c1-3-6-12-7-5-8-14(11-12)15(18-17)16-13(4-2)9-10-19-16/h5,7-11,15,18H,3-4,6,17H2,1-2H3 |
| InChIKey | SDJDJYYGXVWCDE-UHFFFAOYSA-N |
| XLogP | 3.82 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 274.43 |
| LogP ≤ 5 | 3.82 |
| 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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