C126H184F6N14O21S7 — CID 159567160
N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;trans-(1R,4R)-3-methyl-N-[2-methyl-4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide (PubChem CID 159567160) has the molecular formula C126H184F6N14O21S7 and a molecular weight of 2569.39 g/mol. Its IUPAC name is N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;trans-(1R,4R)-3-methyl-N-[2-methyl-4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide.
| Compound Name | N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;trans-(1R,4R)-3-methyl-N-[2-methyl-4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
|---|---|
| PubChem CID | 159567160 |
| Molecular Formula | C126H184F6N14O21S7 |
| Molecular Weight | 2569.39 g/mol |
| Exact Mass | 2567.17 |
| IUPAC Name | N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;trans-(1R,4R)-3-methyl-N-[2-methyl-4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
| SMILES | CC1CCC(Oc2ccc(NC(=O)C3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1C.CCc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)ccc1C(F)(F)F.CCc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)ccc1OC1CCCC1.Cc1c(C(F)(F)F)cnc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c1C.Cc1cc(-c2ncco2)ccc1NC(=O)[C@@H]1CC[C@@H](NS(=O)(=O)C(C)C)C(C)C1.Cc1csc(-c2ccc(NC(=O)C3CCC(NS(=O)(=O)C(C)C)CC3)c(C)c2)c1 |
| InChI | InChI=1S/2C23H36N2O4S.C22H30N2O3S2.C21H29N3O4S.C19H27F3N2O3S.C18H26F3N3O3S/c1-15(2)30(27,28)25-20-8-6-18(7-9-20)23(26)24-19-10-12-21(13-11-19)29-22-14-5-16(3)17(22)4;1-4-17-15-20(13-14-22(17)29-21-7-5-6-8-21)24-23(26)18-9-11-19(12-10-18)25-30(27,28)16(2)3;1-14(2)29(26,27)24-19-8-5-17(6-9-19)22(25)23-20-10-7-18(12-16(20)4)21-11-15(3)13-28-21;1-13(2)29(26,27)24-19-8-5-16(11-15(19)4)20(25)23-18-7-6-17(12-14(18)3)21-22-9-10-28-21;1-4-13-11-16(9-10-17(13)19(20,21)22)23-18(25)14-5-7-15(8-6-14)24-28(26,27)12(2)3;1-10(2)28(26,27)24-14-7-5-13(6-8-14)17(25)23-16-12(4)11(3)15(9-22-16)18(19,20)21/h10-13,15-18,20,22,25H,5-9,14H2,1-4H3,(H,24,26);13-16,18-19,21,25H,4-12H2,1-3H3,(H,24,26);7,10-14,17,19,24H,5-6,8-9H2,1-4H3,(H,23,25);6-7,9-10,12-13,15-16,19,24H,5,8,11H2,1-4H3,(H,23,25);9-12,14-15,24H,4-8H2,1-3H3,(H,23,25);9-10,13-14,24H,5-8H2,1-4H3,(H,22,23,25)/t;;;15?,16-,19-;;/m...1../s1 |
| InChIKey | MHIRFFNAYIIMPB-JKOKXVLZSA-N |
| XLogP | 24.93 |
| TPSA | 509.00 Ų |
| H-Bond Donors | 12 |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 38 |
| Heavy Atoms | 174 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2569.39 |
| LogP ≤ 5 | 24.93 |
| H-Bond Donors ≤ 5 | 12 |
| H-Bond Acceptors ≤ 10 | 24 |