C128H193F8N21O23S7 — CID 158400835
4-(tert-butylsulfonylamino)-N-(4-cyclohexylphenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-fluorophenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(oxan-4-yloxy)phenyl]piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-(4-cyclohexylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluorophenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide (PubChem CID 158400835) has the molecular formula C128H193F8N21O23S7 and a molecular weight of 2770.53 g/mol. Its IUPAC name is 4-(tert-butylsulfonylamino)-N-(4-cyclohexylphenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-fluorophenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(oxan-4-yloxy)phenyl]piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-(4-cyclohexylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluorophenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide.
| Compound Name | 4-(tert-butylsulfonylamino)-N-(4-cyclohexylphenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-fluorophenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(oxan-4-yloxy)phenyl]piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-(4-cyclohexylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluorophenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide |
|---|---|
| PubChem CID | 158400835 |
| Molecular Formula | C128H193F8N21O23S7 |
| Molecular Weight | 2770.53 g/mol |
| Exact Mass | 2768.25 |
| IUPAC Name | 4-(tert-butylsulfonylamino)-N-(4-cyclohexylphenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-fluorophenyl)piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(oxan-4-yloxy)phenyl]piperidine-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide;N-(4-cyclohexylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-(4-fluorophenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide |
| SMILES | CC(C)(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(C3CCCCC3)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)cc2)CC1.CC(C)(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(OC3CCOCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(C3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)cc2)CC1 |
| InChI | InChI=1S/C22H35N3O3S.C21H33N3O5S.C21H33N3O3S.C17H24F3N3O3S.C16H22F3N3O3S.C16H24FN3O3S.C15H22FN3O3S/c1-22(2,3)29(27,28)24-20-13-15-25(16-14-20)21(26)23-19-11-9-18(10-12-19)17-7-5-4-6-8-17;1-21(2,3)30(26,27)23-17-8-12-24(13-9-17)20(25)22-16-4-6-18(7-5-16)29-19-10-14-28-15-11-19;1-16(2)28(26,27)23-20-12-14-24(15-13-20)21(25)22-19-10-8-18(9-11-19)17-6-4-3-5-7-17;1-16(2,3)27(25,26)22-14-8-10-23(11-9-14)15(24)21-13-6-4-12(5-7-13)17(18,19)20;1-11(2)26(24,25)21-14-7-9-22(10-8-14)15(23)20-13-5-3-12(4-6-13)16(17,18)19;1-16(2,3)24(22,23)19-14-8-10-20(11-9-14)15(21)18-13-6-4-12(17)5-7-13;1-11(2)23(21,22)18-14-7-9-19(10-8-14)15(20)17-13-5-3-12(16)4-6-13/h9-12,17,20,24H,4-8,13-16H2,1-3H3,(H,23,26);4-7,17,19,23H,8-15H2,1-3H3,(H,22,25);8-11,16-17,20,23H,3-7,12-15H2,1-2H3,(H,22,25);4-7,14,22H,8-11H2,1-3H3,(H,21,24);3-6,11,14,21H,7-10H2,1-2H3,(H,20,23);4-7,14,19H,8-11H2,1-3H3,(H,18,21);3-6,11,14,18H,7-10H2,1-2H3,(H,17,20) |
| InChIKey | GYBUNBBPMHBXET-UHFFFAOYSA-N |
| XLogP | 22.60 |
| TPSA | 568.03 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 23 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 187 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2770.53 |
| LogP ≤ 5 | 22.60 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 23 |