H0F
Summary
| Name: | 2-[(2~{S})-1-[(2~{S},3~{S})-3-methyl-2-(methylamino)pentanoyl]pyrrolidin-2-yl]ethanamide |
| Formula: | C13 H25 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 255.356 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[(2~{S})-1-[(2~{S},3~{S})-3-methyl-2-(methylamino)pentanoyl]pyrrolidin-2-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H25N3O2/c1-4-9(2)12(15-3)13(18)16-7-5-6-10(16)8-11(14)17/h9-10,12,15H,4-8H2,1-3H3,(H2,14,17)/t9-,10-,12-/m0/s1 |
| InChIKey | InChI | 1.03 | KQPMIECFIMHSIA-NHCYSSNCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@H](C)[C@H](NC)C(=O)N1CCC[C@H]1CC(N)=O |
| SMILES | CACTVS | 3.385 | CC[CH](C)[CH](NC)C(=O)N1CCC[CH]1CC(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1CC(=O)N)NC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(C)C(C(=O)N1CCCC1CC(=O)N)NC |
