A1IM8
Summary
| Name: | (2~{R})-2-azanyl-~{N}-methyl-3-pyridin-4-yl-propanamide |
| Formula: | C9 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 179.219 Da |
| Component type: | D-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-azanyl-~{N}-methyl-3-pyridin-4-yl-propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H13N3O/c1-11-9(13)8(10)6-7-2-4-12-5-3-7/h2-5,8H,6,10H2,1H3,(H,11,13)/t8-/m1/s1 |
| InChIKey | InChI | 1.06 | LJVDSZALHNBLNR-MRVPVSSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)[C@H](N)Cc1ccncc1 |
| SMILES | CACTVS | 3.385 | CNC(=O)[CH](N)Cc1ccncc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNC(=O)[C@@H](Cc1ccncc1)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)C(Cc1ccncc1)N |
