K2J
Summary
| Name: | 4-methoxy-N-methylpyrimidin-2-amine |
| Formula: | C6 H9 N3 O |
| Formal charge: | 0 |
| Formula weight: | 139.155 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methoxy-N-methylpyrimidin-2-amine |
| OpenEye OEToolkits | 2.0.6 | 4-methoxy-~{N}-methyl-pyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1ccc(OC)nc1NC |
| InChI | InChI | 1.03 | InChI=1S/C6H9N3O/c1-7-6-8-4-3-5(9-6)10-2/h3-4H,1-2H3,(H,7,8,9) |
| InChIKey | InChI | 1.03 | OPBJFWASRUHSHW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1nccc(OC)n1 |
| SMILES | CACTVS | 3.385 | CNc1nccc(OC)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNc1nccc(n1)OC |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNc1nccc(n1)OC |
