M6W
(3~{S})-~{N}-methylpyrrolidine-3-carboxamide
Created: | 2019-10-03 |
Last modified: | 2020-03-04 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 1 |
Bond Count | 21 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (3~{S})-~{N}-methylpyrrolidine-3-carboxamide |
Systematic Name (OpenEye OEToolkits) | (3~{S})-~{N}-methylpyrrolidine-3-carboxamide |
Formula | C6 H12 N2 O |
Molecular Weight | 128.172 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CNC(=O)[CH]1CCNC1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)C1CCNC1 |
Canonical SMILES | CACTVS | 3.385 | CNC(=O)[C@H]1CCNC1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)[C@H]1CCNC1 |
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 |
Related Resource References
Resource Name | Reference |
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PubChem | 28280634 |