C205H305F3N26O41S12 — CID 159581146
4-(tert-butylsulfonylamino)-N-(3-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(cyclopropylmethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(furan-2-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(1,2-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexane-1-carboxamide;N-[4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide (PubChem CID 159581146) has the molecular formula C205H305F3N26O41S12 and a molecular weight of 4231.63 g/mol. Its IUPAC name is 4-(tert-butylsulfonylamino)-N-(3-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(cyclopropylmethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(furan-2-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(1,2-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexane-1-carboxamide;N-[4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide.
| Compound Name | 4-(tert-butylsulfonylamino)-N-(3-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(cyclopropylmethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(furan-2-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(1,2-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexane-1-carboxamide;N-[4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
|---|---|
| PubChem CID | 159581146 |
| Molecular Formula | C205H305F3N26O41S12 |
| Molecular Weight | 4231.63 g/mol |
| Exact Mass | 4227.92 |
| IUPAC Name | 4-(tert-butylsulfonylamino)-N-(3-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-cyclohexyloxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(cyclopropylmethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(furan-2-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(1,2-oxazol-5-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[3-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(propan-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[5-(trifluoromethyl)-2-pyridinyl]cyclohexane-1-carboxamide;N-[4-(1,3-oxazol-2-yl)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide |
| SMILES | CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(-c3ccco3)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(-c3ccno3)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(F)(F)F)cn2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3CCCC3=O)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(OC3CCCCC3)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(OC3CCCCC3)c2)CC1.CC(C)(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(OCC3CC3)c2)CC1.CC(C)NS(=O)(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)(C)C)CC2)cc1.CC(C)NS(=O)(=O)c1cccc(NC(=O)C2CCC(NS(=O)(=O)C(C)(C)C)CC2)c1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(-c3ncco3)cc2)CC1 |
| InChI | InChI=1S/2C23H36N2O4S.C21H31N3O4S.C21H28N2O4S.C21H32N2O4S.2C20H33N3O5S2.C20H27N3O4S.C19H25N3O4S.C17H24F3N3O3S/c1-23(2,3)30(27,28)25-18-14-12-17(13-15-18)22(26)24-19-8-7-11-21(16-19)29-20-9-5-4-6-10-20;1-23(2,3)30(27,28)25-19-11-9-17(10-12-19)22(26)24-18-13-15-21(16-14-18)29-20-7-5-4-6-8-20;1-21(2,3)29(27,28)23-17-8-6-15(7-9-17)20(26)22-16-10-12-18(13-11-16)24-14-4-5-19(24)25;1-21(2,3)28(25,26)23-18-12-8-16(9-13-18)20(24)22-17-10-6-15(7-11-17)19-5-4-14-27-19;1-21(2,3)28(25,26)23-17-11-9-16(10-12-17)20(24)22-18-5-4-6-19(13-18)27-14-15-7-8-15;1-14(2)22-29(25,26)18-12-10-16(11-13-18)21-19(24)15-6-8-17(9-7-15)23-30(27,28)20(3,4)5;1-14(2)22-29(25,26)18-8-6-7-17(13-18)21-19(24)15-9-11-16(12-10-15)23-30(27,28)20(3,4)5;1-20(2,3)28(25,26)23-17-10-6-15(7-11-17)19(24)22-16-8-4-14(5-9-16)18-12-13-21-27-18;1-13(2)27(24,25)22-17-9-3-14(4-10-17)18(23)21-16-7-5-15(6-8-16)19-20-11-12-26-19;1-16(2,3)27(25,26)23-13-7-4-11(5-8-13)15(24)22-14-9-6-12(10-21-14)17(18,19)20/h7-8,11,16-18,20,25H,4-6,9-10,12-15H2,1-3H3,(H,24,26);13-17,19-20,25H,4-12H2,1-3H3,(H,24,26);10-13,15,17,23H,4-9,14H2,1-3H3,(H,22,26);4-7,10-11,14,16,18,23H,8-9,12-13H2,1-3H3,(H,22,24);4-6,13,15-17,23H,7-12,14H2,1-3H3,(H,22,24);10-15,17,22-23H,6-9H2,1-5H3,(H,21,24);6-8,13-16,22-23H,9-12H2,1-5H3,(H,21,24);4-5,8-9,12-13,15,17,23H,6-7,10-11H2,1-3H3,(H,22,24);5-8,11-14,17,22H,3-4,9-10H2,1-2H3,(H,21,23);6,9-11,13,23H,4-5,7-8H2,1-3H3,(H,21,22,24) |
| InChIKey | MJAMIIXWIRMRSG-UHFFFAOYSA-N |
| XLogP | 35.32 |
| TPSA | 971.13 Ų |
| H-Bond Donors | 22 |
| H-Bond Acceptors | 44 |
| Rotatable Bonds | 58 |
| Heavy Atoms | 287 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4231.63 |
| LogP ≤ 5 | 35.32 |
| H-Bond Donors ≤ 5 | 22 |
| H-Bond Acceptors ≤ 10 | 44 |