2HH
Summary
| Name: | 1-methyl-N-(pyridin-3-yl)-1H-pyrazole-5-carboxamide |
| Formula: | C10 H10 N4 O |
| Formal charge: | 0 |
| Formula weight: | 202.213 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-methyl-N-(pyridin-3-yl)-1H-pyrazole-5-carboxamide |
| OpenEye OEToolkits | 1.7.6 | 2-methyl-N-pyridin-3-yl-pyrazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1cccnc1)c2ccnn2C |
| InChI | InChI | 1.03 | InChI=1S/C10H10N4O/c1-14-9(4-6-12-14)10(15)13-8-3-2-5-11-7-8/h2-7H,1H3,(H,13,15) |
| InChIKey | InChI | 1.03 | LSEUGEFZKAZGSI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1nccc1C(=O)Nc2cccnc2 |
| SMILES | CACTVS | 3.385 | Cn1nccc1C(=O)Nc2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cn1c(ccn1)C(=O)Nc2cccnc2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cn1c(ccn1)C(=O)Nc2cccnc2 |
