HLG
Summary
| Name: | N-{3-[(4-aminobutyl)amino]propyl}acetamide |
| Formula: | C9 H21 N3 O |
| Formal charge: | 0 |
| Formula weight: | 187.283 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-{3-[(4-aminobutyl)amino]propyl}acetamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[3-(4-azanylbutylamino)propyl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC(NCCCNCCCCN)=O |
| InChI | InChI | 1.03 | InChI=1S/C9H21N3O/c1-9(13)12-8-4-7-11-6-3-2-5-10/h11H,2-8,10H2,1H3,(H,12,13) |
| InChIKey | InChI | 1.03 | MQTAVJHICJWXBR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)NCCCNCCCCN |
| SMILES | CACTVS | 3.385 | CC(=O)NCCCNCCCCN |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)NCCCNCCCCN |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)NCCCNCCCCN |
