A1H9U
Summary
| Name: | ~{N}-(3-azanyl-2-methyl-phenyl)propanamide |
| Synonyms: | N-(3-amino-2-methylphenyl)propanamide |
| Formula: | C10 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 178.231 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(3-azanyl-2-methyl-phenyl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H14N2O/c1-3-10(13)12-9-6-4-5-8(11)7(9)2/h4-6H,3,11H2,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.06 | XFEFCFAFNZDPDF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)Nc1cccc(N)c1C |
| SMILES | CACTVS | 3.385 | CCC(=O)Nc1cccc(N)c1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1cccc(c1C)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1cccc(c1C)N |
