C138H160F11N17O15 — CID 159791161
N-[(2R)-butan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;5-cyano-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-[(3-fluorophenyl)methoxy]-4-(trifluoromethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-5-methylpyridine-3-carboxamide;N-(3,3-dimethylbutyl)-4-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-(2,2-dimethyloxan-4-yl)ethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[3-methyl-3-(trifluoromethyl)cyclobutyl]pyridine-3-carboxamide (PubChem CID 159791161) has the molecular formula C138H160F11N17O15 and a molecular weight of 2505.88 g/mol. Its IUPAC name is N-[(2R)-butan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;5-cyano-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-[(3-fluorophenyl)methoxy]-4-(trifluoromethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-5-methylpyridine-3-carboxamide;N-(3,3-dimethylbutyl)-4-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-(2,2-dimethyloxan-4-yl)ethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[3-methyl-3-(trifluoromethyl)cyclobutyl]pyridine-3-carboxamide.
| Compound Name | N-[(2R)-butan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;5-cyano-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-[(3-fluorophenyl)methoxy]-4-(trifluoromethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-5-methylpyridine-3-carboxamide;N-(3,3-dimethylbutyl)-4-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-(2,2-dimethyloxan-4-yl)ethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[3-methyl-3-(trifluoromethyl)cyclobutyl]pyridine-3-carboxamide |
|---|---|
| PubChem CID | 159791161 |
| Molecular Formula | C138H160F11N17O15 |
| Molecular Weight | 2505.88 g/mol |
| Exact Mass | 2504.21 |
| IUPAC Name | N-[(2R)-butan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;5-cyano-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-[(3-fluorophenyl)methoxy]-4-(trifluoromethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-5-methylpyridine-3-carboxamide;N-(3,3-dimethylbutyl)-4-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-(2,2-dimethyloxan-4-yl)ethyl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[3-methyl-3-(trifluoromethyl)cyclobutyl]pyridine-3-carboxamide |
| SMILES | CC1(C(F)(F)F)CC(NC(=O)c2ccc(OCc3cccc(F)c3)nc2)C1.CC[C@@H](C)NC(=O)c1ccc(OCc2cccc(F)c2)nc1.C[C@@H](NC(=O)c1ccc(OCc2cccc(F)c2)nc1)C1CCOC(C)(C)C1.C[C@@H](NC(=O)c1cnc(OCc2cccc(F)c2)cc1C(F)(F)F)C(C)(C)C.C[C@@H](NC(=O)c1cnc(OCc2ccncc2)c(C#N)c1)C1CCCCC1.Cc1cc(C(=O)NCCC(C)(C)C)cnc1OCc1cccc(F)c1.Cc1cc(OCc2ccncc2)ncc1C(=O)NCCC(C)(C)C |
| InChI | InChI=1S/C22H27FN2O3.C21H24N4O2.C20H22F4N2O2.C20H25FN2O2.C19H18F4N2O2.C19H25N3O2.C17H19FN2O2/c1-15(17-9-10-28-22(2,3)12-17)25-21(26)18-7-8-20(24-13-18)27-14-16-5-4-6-19(23)11-16;1-15(17-5-3-2-4-6-17)25-20(26)19-11-18(12-22)21(24-13-19)27-14-16-7-9-23-10-8-16;1-12(19(2,3)4)26-18(27)15-10-25-17(9-16(15)20(22,23)24)28-11-13-6-5-7-14(21)8-13;1-14-10-16(18(24)22-9-8-20(2,3)4)12-23-19(14)25-13-15-6-5-7-17(21)11-15;1-18(19(21,22)23)8-15(9-18)25-17(26)13-5-6-16(24-10-13)27-11-12-3-2-4-14(20)7-12;1-14-11-17(24-13-15-5-8-20-9-6-15)22-12-16(14)18(23)21-10-7-19(2,3)4;1-3-12(2)20-17(21)14-7-8-16(19-10-14)22-11-13-5-4-6-15(18)9-13/h4-8,11,13,15,17H,9-10,12,14H2,1-3H3,(H,25,26);7-11,13,15,17H,2-6,14H2,1H3,(H,25,26);5-10,12H,11H2,1-4H3,(H,26,27);5-7,10-12H,8-9,13H2,1-4H3,(H,22,24);2-7,10,15H,8-9,11H2,1H3,(H,25,26);5-6,8-9,11-12H,7,10,13H2,1-4H3,(H,21,23);4-10,12H,3,11H2,1-2H3,(H,20,21)/t15-,17?;15-;12-;;;;12-/m111...1/s1 |
| InChIKey | NIOPXLCYVVTWMK-QCJQWNLKSA-N |
| XLogP | 28.12 |
| TPSA | 417.34 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 25 |
| Rotatable Bonds | 40 |
| Heavy Atoms | 181 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2505.88 |
| LogP ≤ 5 | 28.12 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 25 |