4F9
Summary
| Name: | 4-(1H-imidazol-5-yl)pyridine |
| Formula: | C8 H7 N3 |
| Formal charge: | 0 |
| Formula weight: | 145.161 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(1H-imidazol-5-yl)pyridine |
| OpenEye OEToolkits | 1.9.2 | 4-(1H-imidazol-5-yl)pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(ccnc1)c2cncn2 |
| InChI | InChI | 1.03 | InChI=1S/C8H7N3/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1-6H,(H,10,11) |
| InChIKey | InChI | 1.03 | AJQQGJNKKDEODG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [nH]1cncc1c2ccncc2 |
| SMILES | CACTVS | 3.385 | [nH]1cncc1c2ccncc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cnccc1c2cnc[nH]2 |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cnccc1c2cnc[nH]2 |
