A1AQG
Summary
| Name: | (2-fluorophenyl)(piperazin-1-yl)methanone |
| Formula: | C11 H13 F N2 O |
| Formal charge: | 0 |
| Formula weight: | 208.232 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2-fluorophenyl)(piperazin-1-yl)methanone |
| OpenEye OEToolkits | 2.0.7 | (2-fluorophenyl)-piperazin-1-yl-methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1ccccc1F)N1CCNCC1 |
| InChI | InChI | 1.06 | InChI=1S/C11H13FN2O/c12-10-4-2-1-3-9(10)11(15)14-7-5-13-6-8-14/h1-4,13H,5-8H2 |
| InChIKey | InChI | 1.06 | YUOYYPWFXYRVHK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccccc1C(=O)N2CCNCC2 |
| SMILES | CACTVS | 3.385 | Fc1ccccc1C(=O)N2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)N2CCNCC2)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)N2CCNCC2)F |
