C114H173F10N19O19S6 — CID 158398667
N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;2,5-dimethyl-4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluoro-3-methylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide (PubChem CID 158398667) has the molecular formula C114H173F10N19O19S6 and a molecular weight of 2496.13 g/mol. Its IUPAC name is N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;2,5-dimethyl-4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluoro-3-methylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide.
| Compound Name | N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;2,5-dimethyl-4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluoro-3-methylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide |
|---|---|
| PubChem CID | 158398667 |
| Molecular Formula | C114H173F10N19O19S6 |
| Molecular Weight | 2496.13 g/mol |
| Exact Mass | 2494.13 |
| IUPAC Name | N-(4-cyclopentyloxy-3-ethylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;2,5-dimethyl-4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluoro-3-methylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide |
| SMILES | CC1CC(C)CC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1.CC1CN(C(=O)Nc2ccc(C(F)(F)F)cc2)C(C)CC1NS(=O)(=O)C(C)C.CCc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1C(F)(F)F.CCc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1OC1CCCC1.Cc1c(C(F)(F)F)cnc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)c1C.Cc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1F |
| InChI | InChI=1S/C23H37N3O3S.C22H35N3O4S.2C18H26F3N3O3S.C17H25F3N4O3S.C16H24FN3O3S/c1-16(2)30(28,29)25-22-9-11-26(12-10-22)23(27)24-21-7-5-19(6-8-21)20-14-17(3)13-18(4)15-20;1-4-17-15-19(9-10-21(17)29-20-7-5-6-8-20)23-22(26)25-13-11-18(12-14-25)24-30(27,28)16(2)3;1-11(2)28(26,27)23-16-9-13(4)24(10-12(16)3)17(25)22-15-7-5-14(6-8-15)18(19,20)21;1-4-13-11-15(5-6-16(13)18(19,20)21)22-17(25)24-9-7-14(8-10-24)23-28(26,27)12(2)3;1-10(2)28(26,27)23-13-5-7-24(8-6-13)16(25)22-15-12(4)11(3)14(9-21-15)17(18,19)20;1-11(2)24(22,23)19-13-6-8-20(9-7-13)16(21)18-14-4-5-15(17)12(3)10-14/h5-8,16-18,20,22,25H,9-15H2,1-4H3,(H,24,27);9-10,15-16,18,20,24H,4-8,11-14H2,1-3H3,(H,23,26);5-8,11-13,16,23H,9-10H2,1-4H3,(H,22,25);5-6,11-12,14,23H,4,7-10H2,1-3H3,(H,22,25);9-10,13,23H,5-8H2,1-4H3,(H,21,22,25);4-5,10-11,13,19H,6-9H2,1-3H3,(H,18,21) |
| InChIKey | GXVJRZWJMMCHIJ-UHFFFAOYSA-N |
| XLogP | 21.20 |
| TPSA | 493.18 Ų |
| H-Bond Donors | 12 |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 29 |
| Heavy Atoms | 168 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2496.13 |
| LogP ≤ 5 | 21.20 |
| H-Bond Donors ≤ 5 | 12 |
| H-Bond Acceptors ≤ 10 | 20 |