C148H175F14N19O16 — CID 159403058
5-cyano-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(2R)-1-[4-(1,1-difluoroethyl)piperidin-1-yl]propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(2R)-1-(3-fluoro-3-methylpyrrolidin-1-yl)propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide (PubChem CID 159403058) has the molecular formula C148H175F14N19O16 and a molecular weight of 2742.12 g/mol. Its IUPAC name is 5-cyano-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(2R)-1-[4-(1,1-difluoroethyl)piperidin-1-yl]propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(2R)-1-(3-fluoro-3-methylpyrrolidin-1-yl)propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide.
| Compound Name | 5-cyano-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(2R)-1-[4-(1,1-difluoroethyl)piperidin-1-yl]propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(2R)-1-(3-fluoro-3-methylpyrrolidin-1-yl)propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide |
|---|---|
| PubChem CID | 159403058 |
| Molecular Formula | C148H175F14N19O16 |
| Molecular Weight | 2742.12 g/mol |
| Exact Mass | 2740.32 |
| IUPAC Name | 5-cyano-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3-fluorophenyl)methoxy]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(2R)-1-[4-(1,1-difluoroethyl)piperidin-1-yl]propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]-2-methoxypyridine-3-carboxamide;N-[(2R)-1-(3-fluoro-3-methylpyrrolidin-1-yl)propan-2-yl]-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide |
| SMILES | CC(C)(C)CCNC(=O)c1cnc(OCc2ccncc2)c(C#N)c1.COc1nc(OCc2cccc(F)c2)ccc1C(=O)NCCC(C)(C)C.COc1nc(OCc2cccc(F)c2)ccc1C(=O)N[C@H](C)C1CCCCC1.C[C@@H](NC(=O)c1cnc(OCc2cccc(F)c2)c(C(F)(F)F)c1)C1CCCCC1.C[C@@H](NC(=O)c1cnc(OCc2ccncc2)c(C(F)(F)F)c1)C1CCCCC1.C[C@H](CN1CCC(C(C)(F)F)CC1)NC(=O)c1ccc(OCc2cccc(F)c2)nc1.C[C@H](CN1CCC(C)(F)C1)NC(=O)c1ccc(OCc2cccc(F)c2)nc1 |
| InChI | InChI=1S/C23H28F3N3O2.C22H24F4N2O2.C22H27FN2O3.C21H24F3N3O2.C21H25F2N3O2.C20H25FN2O3.C19H22N4O2/c1-16(14-29-10-8-19(9-11-29)23(2,25)26)28-22(30)18-6-7-21(27-13-18)31-15-17-4-3-5-20(24)12-17;1-14(16-7-3-2-4-8-16)28-20(29)17-11-19(22(24,25)26)21(27-12-17)30-13-15-6-5-9-18(23)10-15;1-15(17-8-4-3-5-9-17)24-21(26)19-11-12-20(25-22(19)27-2)28-14-16-7-6-10-18(23)13-16;1-14(16-5-3-2-4-6-16)27-19(28)17-11-18(21(22,23)24)20(26-12-17)29-13-15-7-9-25-10-8-15;1-15(12-26-9-8-21(2,23)14-26)25-20(27)17-6-7-19(24-11-17)28-13-16-4-3-5-18(22)10-16;1-20(2,3)10-11-22-18(24)16-8-9-17(23-19(16)25-4)26-13-14-6-5-7-15(21)12-14;1-19(2,3)6-9-22-17(24)16-10-15(11-20)18(23-12-16)25-13-14-4-7-21-8-5-14/h3-7,12-13,16,19H,8-11,14-15H2,1-2H3,(H,28,30);5-6,9-12,14,16H,2-4,7-8,13H2,1H3,(H,28,29);6-7,10-13,15,17H,3-5,8-9,14H2,1-2H3,(H,24,26);7-12,14,16H,2-6,13H2,1H3,(H,27,28);3-7,10-11,15H,8-9,12-14H2,1-2H3,(H,25,27);5-9,12H,10-11,13H2,1-4H3,(H,22,24);4-5,7-8,10,12H,6,9,13H2,1-3H3,(H,22,24)/t16-;14-;15-;14-;15-,21?;;/m11111../s1 |
| InChIKey | LNPFDNPQICVXOR-ANHVQPDGSA-N |
| XLogP | 29.50 |
| TPSA | 433.05 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 28 |
| Rotatable Bonds | 47 |
| Heavy Atoms | 197 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2742.12 |
| LogP ≤ 5 | 29.50 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 28 |