3-Fluoro-4-piperazin-1-yl-benzonitrile
3-fluoro-4-piperazin-1-ylbenzonitrile
Also Known As: 3-fluoro-4-(piperazin-1-yl)benzonitrile|3-Fluoro-4-piperazinobenzonitrile|3-fluoro-4-piperazin-1-ylbenzonitrile|3-Fluoro-4-piperazin-1-yl-benzonitrile|3-Fluoro-4-piperazinylbenzenecarbonitrile|Benzonitrile, 3-fluoro-4-(1-piperazinyl)-|Oprea1_459199|Jsp003731|TPL0402|3-FLUORO-4-PIPERAZINYLBENZONITRILE|2-THIOPHEN-2-YL-ACETAMIDINE|3-Fluoro-4-(1-piperazinyl)benzonitrile|AC-2591|1-(4-cyano--2-fluorophenyl)piperazine|3-Fluoro-4-(1-piperazinyl)benzonitrile #|Benzonitrile,3-fluoro-4-(1-piperazinyl)-
| Molecular Formula | C11H12FN3 |
|---|---|
| Molecular Weight | 205.10153 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 39.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.10153 |
| Monoisotopic Mass | 205.10153 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 79673-53-3 |
|---|---|
| SMILES | C1CN(CCN1)C2=C(C=C(C=C2)C#N)F |
| InChIKey | VMOBEAUQUPPPON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Fluoro-4-piperazin-1-yl-benzonitrile (CAS 79673-53-3), with molecular formula C11H12FN3 and molecular weight 205.10153 g/mol. IUPAC: 3-fluoro-4-piperazin-1-ylbenzonitrile.