UM2
Summary
| Name: | (2S)-2-amino-N-butyl-propanamide |
| Synonyms: | N-butyl-L-alaninamide |
| Formula: | C7 H16 N2 O |
| Formal charge: | 0 |
| Formula weight: | 144.215 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-butyl-L-alaninamide |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-N-butyl-propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NCCCC)C(N)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCNC(=O)[C@H](C)N |
| SMILES | CACTVS | 3.341 | CCCCNC(=O)[CH](C)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCNC(=O)[C@H](C)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCNC(=O)C(C)N |
| InChI | InChI | 1.03 | InChI=1S/C7H16N2O/c1-3-4-5-9-7(10)6(2)8/h6H,3-5,8H2,1-2H3,(H,9,10)/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | XXYQJGUBGFEJMV-LURJTMIESA-N |
