A1ANA
Summary
| Name: | 4-amino-N-cyclobutyl-1-methyl-1H-pyrazole-3-carboxamide |
| Formula: | C9 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 194.234 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-amino-N-cyclobutyl-1-methyl-1H-pyrazole-3-carboxamide |
| OpenEye OEToolkits | 2.0.7 | 4-azanyl-~{N}-cyclobutyl-1-methyl-pyrazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Nc1cn(C)nc1C(=O)NC1CCC1 |
| InChI | InChI | 1.06 | InChI=1S/C9H14N4O/c1-13-5-7(10)8(12-13)9(14)11-6-3-2-4-6/h5-6H,2-4,10H2,1H3,(H,11,14) |
| InChIKey | InChI | 1.06 | NILOPFIVQCAHIP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(N)c(n1)C(=O)NC2CCC2 |
| SMILES | CACTVS | 3.385 | Cn1cc(N)c(n1)C(=O)NC2CCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1cc(c(n1)C(=O)NC2CCC2)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1cc(c(n1)C(=O)NC2CCC2)N |
