UG0
6-fluoranyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
| Created: | 2023-02-03 |
| Last modified: | 2024-02-21 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 31 |
| Chiral Atom Count | 0 |
| Bond Count | 32 |
| Aromatic Bond Count | 12 |
Chemical Component Summary | |
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| Name | 6-fluoranyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide |
| Systematic Name (OpenEye OEToolkits) | 6-fluoranyl-~{N}-[(4-methylphenyl)methyl]pyridine-3-carboxamide |
| Formula | C14 H13 F N2 O |
| Molecular Weight | 244.264 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 3.385 | Cc1ccc(CNC(=O)c2ccc(F)nc2)cc1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)CNC(=O)c2ccc(nc2)F |
| Canonical SMILES | CACTVS | 3.385 | Cc1ccc(CNC(=O)c2ccc(F)nc2)cc1 |
| Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1)CNC(=O)c2ccc(nc2)F |
| InChI | InChI | 1.06 | InChI=1S/C14H13FN2O/c1-10-2-4-11(5-3-10)8-17-14(18)12-6-7-13(15)16-9-12/h2-7,9H,8H2,1H3,(H,17,18) |
| InChIKey | InChI | 1.06 | QKRGNSPFHXLCPB-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 63970976 |














