A1I84
Summary
| Name: | 5-chloranyl-2-(cyclopropylamino)-~{N}-(2-hydroxyethyl)pyridine-4-carboxamide |
| Formula: | C11 H14 Cl N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 255.701 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-chloranyl-2-(cyclopropylamino)-~{N}-(2-hydroxyethyl)pyridine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H14ClN3O2/c12-9-6-14-10(15-7-1-2-7)5-8(9)11(17)13-3-4-16/h5-7,16H,1-4H2,(H,13,17)(H,14,15) |
| InChIKey | InChI | 1.06 | QUXONIHSWZGNKT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCNC(=O)c1cc(NC2CC2)ncc1Cl |
| SMILES | CACTVS | 3.385 | OCCNC(=O)c1cc(NC2CC2)ncc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c(cnc1NC2CC2)Cl)C(=O)NCCO |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c(cnc1NC2CC2)Cl)C(=O)NCCO |
