A1C9Y
Summary
| Name: | N-[(1S)-1-cyclopropylethyl]-2-oxo-1,2-dihydropyridine-3-carboxamide |
| Formula: | C11 H14 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 206.241 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-[(1S)-1-cyclopropylethyl]-2-oxo-1,2-dihydropyridine-3-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-[(1~{S})-1-cyclopropylethyl]-2-oxidanylidene-1~{H}-pyridine-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(NC(C)C1CC1)C1=CC=CNC1=O |
| InChI | InChI | 1.06 | InChI=1S/C11H14N2O2/c1-7(8-4-5-8)13-11(15)9-3-2-6-12-10(9)14/h2-3,6-8H,4-5H2,1H3,(H,12,14)(H,13,15)/t7-/m0/s1 |
| InChIKey | InChI | 1.06 | JWAIUNSAJMVLEO-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](NC(=O)C1=CC=CNC1=O)C2CC2 |
| SMILES | CACTVS | 3.385 | C[CH](NC(=O)C1=CC=CNC1=O)C2CC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@@H](C1CC1)NC(=O)C2=CC=CNC2=O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C1CC1)NC(=O)C2=CC=CNC2=O |
