C11H11BrFN3S — CID 105248249
[2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine (PubChem CID 105248249) has the molecular formula C11H11BrFN3S and a molecular weight of 316.20 g/mol. Its IUPAC name is [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine.
| Compound Name | [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine |
|---|---|
| PubChem CID | 105248249 |
| Molecular Formula | C11H11BrFN3S |
| Molecular Weight | 316.20 g/mol |
| Exact Mass | 314.98 |
| IUPAC Name | [2-(5-bromothiophen-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine |
| SMILES | NNC(Cc1ccc(Br)s1)c1ccc(F)cn1 |
| InChI | InChI=1S/C11H11BrFN3S/c12-11-4-2-8(17-11)5-10(16-14)9-3-1-7(13)6-15-9/h1-4,6,10,16H,5,14H2 |
| InChIKey | BFIUSLPWVNAKMV-UHFFFAOYSA-N |
| XLogP | 2.79 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 316.20 |
| LogP ≤ 5 | 2.79 |
| 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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