C143H183Br2F6N19O15 — CID 160891887
5-bromo-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-bromo-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-cyano-N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-5-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-(pyridin-4-ylmethoxy)-4-(trifluoromethyl)pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]pyridine-3-carboxamide;methane (PubChem CID 160891887) has the molecular formula C143H183Br2F6N19O15 and a molecular weight of 2681.95 g/mol. Its IUPAC name is 5-bromo-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-bromo-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-cyano-N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-5-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-(pyridin-4-ylmethoxy)-4-(trifluoromethyl)pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]pyridine-3-carboxamide;methane.
| Compound Name | 5-bromo-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-bromo-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-cyano-N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-5-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-(pyridin-4-ylmethoxy)-4-(trifluoromethyl)pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]pyridine-3-carboxamide;methane |
|---|---|
| PubChem CID | 160891887 |
| Molecular Formula | C143H183Br2F6N19O15 |
| Molecular Weight | 2681.95 g/mol |
| Exact Mass | 2678.24 |
| IUPAC Name | 5-bromo-N-[(1R)-1-cyclohexylethyl]-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-bromo-N-(3,3-dimethylbutyl)-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;5-cyano-N-(3,3-dimethylbutyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-5-methyl-6-(pyridin-4-ylmethoxy)pyridine-3-carboxamide;N-[(2R)-3,3-dimethylbutan-2-yl]-6-(pyridin-4-ylmethoxy)-4-(trifluoromethyl)pyridine-3-carboxamide;6-[(3-fluorophenyl)methoxy]-N-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]pyridine-3-carboxamide;methane |
| SMILES | C.C.C.C.CC(C)(C)CCNC(=O)c1cnc(OCc2cccc(F)c2)c(C#N)c1.CC(C)(C)CCNC(=O)c1cnc(OCc2ccncc2)c(Br)c1.CC(COC(C)(C)C)NC(=O)c1ccc(OCc2cccc(F)c2)nc1.CC(NC(=O)c1ccc(OCc2cccc(F)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1cnc(OCc2ccncc2)c(Br)c1)C1CCCCC1.C[C@@H](NC(=O)c1cnc(OCc2ccncc2)cc1C(F)(F)F)C(C)(C)C.Cc1cc(C(=O)N[C@H](C)C2CCCCC2)cnc1OCc1ccncc1 |
| InChI | InChI=1S/C21H25FN2O2.C21H27N3O2.C20H24BrN3O2.C20H22FN3O2.C20H25FN2O3.C19H22F3N3O2.C18H22BrN3O2.4CH4/c1-15(17-7-3-2-4-8-17)24-21(25)18-10-11-20(23-13-18)26-14-16-6-5-9-19(22)12-16;1-15-12-19(20(25)24-16(2)18-6-4-3-5-7-18)13-23-21(15)26-14-17-8-10-22-11-9-17;1-14(16-5-3-2-4-6-16)24-19(25)17-11-18(21)20(23-12-17)26-13-15-7-9-22-10-8-15;1-20(2,3)7-8-23-18(25)16-10-15(11-22)19(24-12-16)26-13-14-5-4-6-17(21)9-14;1-14(12-26-20(2,3)4)23-19(24)16-8-9-18(22-11-16)25-13-15-6-5-7-17(21)10-15;1-12(18(2,3)4)25-17(26)14-10-24-16(9-15(14)19(20,21)22)27-11-13-5-7-23-8-6-13;1-18(2,3)6-9-21-16(23)14-10-15(19)17(22-11-14)24-12-13-4-7-20-8-5-13;;;;/h5-6,9-13,15,17H,2-4,7-8,14H2,1H3,(H,24,25);8-13,16,18H,3-7,14H2,1-2H3,(H,24,25);7-12,14,16H,2-6,13H2,1H3,(H,24,25);4-6,9-10,12H,7-8,13H2,1-3H3,(H,23,25);5-11,14H,12-13H2,1-4H3,(H,23,24);5-10,12H,11H2,1-4H3,(H,25,26);4-5,7-8,10-11H,6,9,12H2,1-3H3,(H,21,23);4*1H4/t;16-;14-;;;12-;;;;;/m.11..1...../s1 |
| InChIKey | SOJMAVYQMDLBOJ-LPJXTQEWSA-N |
| XLogP | 31.42 |
| TPSA | 443.12 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 27 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 185 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2681.95 |
| LogP ≤ 5 | 31.42 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 27 |