M6W
Summary
Name: | (3~{S})-~{N}-methylpyrrolidine-3-carboxamide |
Formula: | C6 H12 N2 O |
Formal charge: | 0 |
Formula weight: | 128.172 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (3~{S})-~{N}-methylpyrrolidine-3-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C6H12N2O/c1-7-6(9)5-2-3-8-4-5/h5,8H,2-4H2,1H3,(H,7,9)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | BVOWXWSHDIGNRE-YFKPBYRVSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)[C@H]1CCNC1 |
SMILES | CACTVS | 3.385 | CNC(=O)[CH]1CCNC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNC(=O)[C@H]1CCNC1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)C1CCNC1 |