A1BMQ
Summary
| Name: | 1-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanamine |
| Formula: | C9 H8 F N3 O |
| Formal charge: | 0 |
| Formula weight: | 193.178 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 1-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanamine |
| OpenEye OEToolkits | 3.1.0.0 | [5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NCc1nc(on1)c1ccccc1F |
| InChI | InChI | 1.06 | InChI=1S/C9H8FN3O/c10-7-4-2-1-3-6(7)9-12-8(5-11)13-14-9/h1-4H,5,11H2 |
| InChIKey | InChI | 1.06 | HKUICAVZWQJAEL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1noc(n1)c2ccccc2F |
| SMILES | CACTVS | 3.385 | NCc1noc(n1)c2ccccc2F |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(c(c1)c2nc(no2)CN)F |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(c(c1)c2nc(no2)CN)F |
