C133H142F18N26O13 — CID 164970398
N-[6-(dimethylamino)-2-(4-hydroxycyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-(dimethylamino)-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4,4-dimethylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxycyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxy-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 164970398) has the molecular formula C133H142F18N26O13 and a molecular weight of 2654.73 g/mol. Its IUPAC name is N-[6-(dimethylamino)-2-(4-hydroxycyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-(dimethylamino)-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4,4-dimethylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxycyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxy-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide.
| Compound Name | N-[6-(dimethylamino)-2-(4-hydroxycyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-(dimethylamino)-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4,4-dimethylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxycyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxy-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide |
|---|---|
| PubChem CID | 164970398 |
| Molecular Formula | C133H142F18N26O13 |
| Molecular Weight | 2654.73 g/mol |
| Exact Mass | 2653.10 |
| IUPAC Name | N-[6-(dimethylamino)-2-(4-hydroxycyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-(dimethylamino)-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4,4-dimethylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxycyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(4-hydroxy-4-methylcyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide |
| SMILES | CC1CCC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(N(C)C)cc3n2)CC1.CN(C)c1cc2nn(C3CCC(O)CC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CCC(C)(C)CC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CCC(C)(O)CC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CCC(C)CC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CCC(O)CC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1 |
| InChI | InChI=1S/C23H26F3N5O.C23H25F3N4O2.C22H24F3N5O2.C22H23F3N4O3.C22H23F3N4O2.C21H21F3N4O3/c1-14-7-9-16(10-8-14)31-13-15-11-19(20(30(2)3)12-18(15)29-31)28-22(32)17-5-4-6-21(27-17)23(24,25)26;1-22(2)9-7-15(8-10-22)30-13-14-11-18(19(32-3)12-17(14)29-30)28-21(31)16-5-4-6-20(27-16)23(24,25)26;1-29(2)19-11-17-13(12-30(28-17)14-6-8-15(31)9-7-14)10-18(19)27-21(32)16-4-3-5-20(26-16)22(23,24)25;1-21(31)8-6-14(7-9-21)29-12-13-10-17(18(32-2)11-16(13)28-29)27-20(30)15-4-3-5-19(26-15)22(23,24)25;1-13-6-8-15(9-7-13)29-12-14-10-18(19(31-2)11-17(14)28-29)27-21(30)16-4-3-5-20(26-16)22(23,24)25;1-31-18-10-16-12(11-28(27-16)13-5-7-14(29)8-6-13)9-17(18)26-20(30)15-3-2-4-19(25-15)21(22,23)24/h4-6,11-14,16H,7-10H2,1-3H3,(H,28,32);4-6,11-13,15H,7-10H2,1-3H3,(H,28,31);3-5,10-12,14-15,31H,6-9H2,1-2H3,(H,27,32);3-5,10-12,14,31H,6-9H2,1-2H3,(H,27,30);3-5,10-13,15H,6-9H2,1-2H3,(H,27,30);2-4,9-11,13-14,29H,5-8H2,1H3,(H,26,30) |
| InChIKey | DAUGBLKWVKDVKC-UHFFFAOYSA-N |
| XLogP | 29.84 |
| TPSA | 462.95 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 190 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2654.73 |
| LogP ≤ 5 | 29.84 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 33 |