8RY
Summary
| Name: | N-methylpyrimidine-2-carboxamide |
| Formula: | C6 H7 N3 O |
| Formal charge: | 0 |
| Formula weight: | 137.139 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methylpyrimidine-2-carboxamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-methylpyrimidine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C)C(c1ncccn1)=O |
| InChI | InChI | 1.03 | InChI=1S/C6H7N3O/c1-7-6(10)5-8-3-2-4-9-5/h2-4H,1H3,(H,7,10) |
| InChIKey | InChI | 1.03 | FJMKLLGSSGMGBM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1ncccn1 |
| SMILES | CACTVS | 3.385 | CNC(=O)c1ncccn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1ncccn1 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1ncccn1 |
