HR5
Summary
| Name: | ~{N}-(cyclobutylmethyl)-1,5-dimethyl-pyrazole-4-carboxamide |
| Formula: | C11 H17 N3 O |
| Formal charge: | 0 |
| Formula weight: | 207.272 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(cyclobutylmethyl)-1,5-dimethyl-pyrazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H17N3O/c1-8-10(7-13-14(8)2)11(15)12-6-9-4-3-5-9/h7,9H,3-6H2,1-2H3,(H,12,15) |
| InChIKey | InChI | 1.03 | WFWUJGIABNGBBR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1ncc(C(=O)NCC2CCC2)c1C |
| SMILES | CACTVS | 3.385 | Cn1ncc(C(=O)NCC2CCC2)c1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1c(cnn1C)C(=O)NCC2CCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1c(cnn1C)C(=O)NCC2CCC2 |
