U0V
Summary
| Name: | 2-fluoro-N-[2-(pyridin-4-yl)ethyl]benzamide |
| Formula: | C14 H13 F N2 O |
| Formal charge: | 0 |
| Formula weight: | 244.264 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-fluoro-N-[2-(pyridin-4-yl)ethyl]benzamide |
| OpenEye OEToolkits | 2.0.7 | 2-fluoranyl-~{N}-(2-pyridin-4-ylethyl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(CCNC(c1c(F)cccc1)=O)ccncc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H13FN2O/c15-13-4-2-1-3-12(13)14(18)17-10-7-11-5-8-16-9-6-11/h1-6,8-9H,7,10H2,(H,17,18) |
| InChIKey | InChI | 1.03 | HQJMILNSKHZGJL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccccc1C(=O)NCCc2ccncc2 |
| SMILES | CACTVS | 3.385 | Fc1ccccc1C(=O)NCCc2ccncc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)NCCc2ccncc2)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)NCCc2ccncc2)F |
