C200H295F3N26O41S12 — CID 158172062
N-(3-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(4-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(cyclopropylmethoxy)-4-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(furan-2-yl)-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(5-methyl-1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-methyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(1,2-oxazol-5-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide (PubChem CID 158172062) has the molecular formula C200H295F3N26O41S12 and a molecular weight of 4161.50 g/mol. Its IUPAC name is N-(3-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(4-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(cyclopropylmethoxy)-4-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(furan-2-yl)-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(5-methyl-1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-methyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(1,2-oxazol-5-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide.
| Compound Name | N-(3-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(4-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(cyclopropylmethoxy)-4-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(furan-2-yl)-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(5-methyl-1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-methyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(1,2-oxazol-5-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
|---|---|
| PubChem CID | 158172062 |
| Molecular Formula | C200H295F3N26O41S12 |
| Molecular Weight | 4161.50 g/mol |
| Exact Mass | 4157.84 |
| IUPAC Name | N-(3-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(4-cyclohexyloxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(cyclopropylmethoxy)-4-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(furan-2-yl)-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(5-methyl-1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-methyl-5-(trifluoromethyl)-2-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(1,2-oxazol-5-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(2-oxopyrrolidin-1-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[3-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(propan-2-ylsulfamoyl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
| SMILES | CC(C)NS(=O)(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1.CC(C)NS(=O)(=O)c1cccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(-c3ccno3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3CCCC3=O)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(OC3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(OC3CCCCC3)c2)CC1.Cc1cc(-c2ccco2)ccc1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1cc(C(F)(F)F)cnc1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OCC1CC1.Cc1cnc(-c2ccc(NC(=O)C3CCC(NS(=O)(=O)C(C)C)CC3)cc2)o1 |
| InChI | InChI=1S/2C22H34N2O4S.C21H32N2O4S.C21H28N2O4S.C20H27N3O4S.C20H29N3O4S.2C19H31N3O5S2.C19H25N3O4S.C17H24F3N3O3S/c1-16(2)29(26,27)24-18-13-11-17(12-14-18)22(25)23-19-7-6-10-21(15-19)28-20-8-4-3-5-9-20;1-16(2)29(26,27)24-19-10-8-17(9-11-19)22(25)23-18-12-14-21(15-13-18)28-20-6-4-3-5-7-20;1-14(2)28(25,26)23-18-10-7-17(8-11-18)21(24)22-19-9-4-15(3)20(12-19)27-13-16-5-6-16;1-14(2)28(25,26)23-18-9-6-16(7-10-18)21(24)22-19-11-8-17(13-15(19)3)20-5-4-12-27-20;1-13(2)28(25,26)23-18-10-4-15(5-11-18)19(24)22-17-8-6-16(7-9-17)20-21-12-14(3)27-20;1-14(2)28(26,27)22-17-7-5-15(6-8-17)20(25)21-16-9-11-18(12-10-16)23-13-3-4-19(23)24;1-13(2)21-29(26,27)18-11-9-16(10-12-18)20-19(23)15-5-7-17(8-6-15)22-28(24,25)14(3)4;1-13(2)21-29(26,27)18-7-5-6-17(12-18)20-19(23)15-8-10-16(11-9-15)22-28(24,25)14(3)4;1-13(2)27(24,25)22-17-9-5-15(6-10-17)19(23)21-16-7-3-14(4-8-16)18-11-12-20-26-18;1-10(2)27(25,26)23-14-6-4-12(5-7-14)16(24)22-15-11(3)8-13(9-21-15)17(18,19)20/h6-7,10,15-18,20,24H,3-5,8-9,11-14H2,1-2H3,(H,23,25);12-17,19-20,24H,3-11H2,1-2H3,(H,23,25);4,9,12,14,16-18,23H,5-8,10-11,13H2,1-3H3,(H,22,24);4-5,8,11-14,16,18,23H,6-7,9-10H2,1-3H3,(H,22,24);6-9,12-13,15,18,23H,4-5,10-11H2,1-3H3,(H,22,24);9-12,14-15,17,22H,3-8,13H2,1-2H3,(H,21,25);9-15,17,21-22H,5-8H2,1-4H3,(H,20,23);5-7,12-16,21-22H,8-11H2,1-4H3,(H,20,23);3-4,7-8,11-13,15,17,22H,5-6,9-10H2,1-2H3,(H,21,23);8-10,12,14,23H,4-7H2,1-3H3,(H,21,22,24) |
| InChIKey | FXOOVUCAAGWJTP-UHFFFAOYSA-N |
| XLogP | 33.05 |
| TPSA | 971.13 Ų |
| H-Bond Donors | 22 |
| H-Bond Acceptors | 44 |
| Rotatable Bonds | 67 |
| Heavy Atoms | 282 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4161.50 |
| LogP ≤ 5 | 33.05 |
| H-Bond Donors ≤ 5 | 22 |
| H-Bond Acceptors ≤ 10 | 44 |