NNU
Summary
| Name: | 1-(4-chloropyridin-3-yl)methanamine |
| Formula: | C6 H7 Cl N2 |
| Formal charge: | 0 |
| Formula weight: | 142.586 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(4-chloropyridin-3-yl)methanamine |
| OpenEye OEToolkits | 1.7.2 | (4-chloranylpyridin-3-yl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccncc1CN |
| InChI | InChI | 1.03 | InChI=1S/C6H7ClN2/c7-6-1-2-9-4-5(6)3-8/h1-2,4H,3,8H2 |
| InChIKey | InChI | 1.03 | ORHVJXZYOADENO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | NCc1cnccc1Cl |
| SMILES | CACTVS | 3.370 | NCc1cnccc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1cncc(c1Cl)CN |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1cncc(c1Cl)CN |
