1HD
Summary
| Name: | N-[(2S)-2-amino-3-hydroxypropyl]acetamide |
| Formula: | C5 H12 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 132.161 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(2S)-2-amino-3-hydroxypropyl]acetamide |
| OpenEye OEToolkits | 1.7.6 | N-[(2S)-2-azanyl-3-oxidanyl-propyl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NCC(N)CO)C |
| InChI | InChI | 1.03 | InChI=1S/C5H12N2O2/c1-4(9)7-2-5(6)3-8/h5,8H,2-3,6H2,1H3,(H,7,9)/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | FGWRNRQRNIHEGV-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(=O)NC[C@H](N)CO |
| SMILES | CACTVS | 3.370 | CC(=O)NC[CH](N)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)NC[C@@H](CO)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)NCC(CO)N |
