C146H223F10N17O26S9 — CID 159250278
N-(4-cyclopentyloxy-3-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-fluorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]pentanamide (PubChem CID 159250278) has the molecular formula C146H223F10N17O26S9 and a molecular weight of 3111.07 g/mol. Its IUPAC name is N-(4-cyclopentyloxy-3-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-fluorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]pentanamide.
| Compound Name | N-(4-cyclopentyloxy-3-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-fluorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]pentanamide |
|---|---|
| PubChem CID | 159250278 |
| Molecular Formula | C146H223F10N17O26S9 |
| Molecular Weight | 3111.07 g/mol |
| Exact Mass | 3108.40 |
| IUPAC Name | N-(4-cyclopentyloxy-3-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[4-(2,3-dimethylcyclopentyl)oxyphenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3,4-dimethyl-5-(trifluoromethyl)-2-pyridinyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-[3-ethyl-4-(trifluoromethyl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-fluorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-[2-methyl-4-(4-methylthiophen-2-yl)phenyl]-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethyl)phenyl]pentanamide |
| SMILES | CC(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(C(F)(F)F)cc1.CC(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(F)cc1.CC1CC(C)CC(c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)C)cc2)C1.CC1CCC(Oc2ccc(NC(=O)CCCCNS(=O)(=O)C(C)C)cc2)C1C.CCc1cc(NC(=O)CCCCNS(=O)(=O)C(C)C)ccc1C(F)(F)F.CCc1cc(NC(=O)CCCCNS(=O)(=O)C(C)C)ccc1OC1CCCC1.Cc1c(C(F)(F)F)cnc(NC(=O)CCCCNS(=O)(=O)C(C)C)c1C.Cc1csc(-c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)C)c(C)c2)c1 |
| InChI | InChI=1S/C22H36N2O3S.2C21H34N2O4S.C20H28N2O3S2.C17H25F3N2O3S.C16H24F3N3O3S.C15H21F3N2O3S.C14H21FN2O3S/c1-16(2)28(26,27)23-12-6-5-7-22(25)24-21-10-8-19(9-11-21)20-14-17(3)13-18(4)15-20;1-15(2)28(25,26)22-14-6-5-7-21(24)23-18-9-11-19(12-10-18)27-20-13-8-16(3)17(20)4;1-4-17-15-18(12-13-20(17)27-19-9-5-6-10-19)23-21(24)11-7-8-14-22-28(25,26)16(2)3;1-14(2)27(24,25)21-10-6-5-7-20(23)22-18-9-8-17(12-16(18)4)19-11-15(3)13-26-19;1-4-13-11-14(8-9-15(13)17(18,19)20)22-16(23)7-5-6-10-21-26(24,25)12(2)3;1-10(2)26(24,25)21-8-6-5-7-14(23)22-15-12(4)11(3)13(9-20-15)16(17,18)19;1-11(2)24(22,23)19-10-4-3-5-14(21)20-13-8-6-12(7-9-13)15(16,17)18;1-11(2)21(19,20)16-10-4-3-5-14(18)17-13-8-6-12(15)7-9-13/h8-11,16-18,20,23H,5-7,12-15H2,1-4H3,(H,24,25);9-12,15-17,20,22H,5-8,13-14H2,1-4H3,(H,23,24);12-13,15-16,19,22H,4-11,14H2,1-3H3,(H,23,24);8-9,11-14,21H,5-7,10H2,1-4H3,(H,22,23);8-9,11-12,21H,4-7,10H2,1-3H3,(H,22,23);9-10,21H,5-8H2,1-4H3,(H,20,22,23);6-9,11,19H,3-5,10H2,1-2H3,(H,20,21);6-9,11,16H,3-5,10H2,1-2H3,(H,17,18) |
| InChIKey | KVFAZNOTEFHDJW-UHFFFAOYSA-N |
| XLogP | 29.34 |
| TPSA | 633.51 Ų |
| H-Bond Donors | 16 |
| H-Bond Acceptors | 28 |
| Rotatable Bonds | 72 |
| Heavy Atoms | 208 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3111.07 |
| LogP ≤ 5 | 29.34 |
| H-Bond Donors ≤ 5 | 16 |
| H-Bond Acceptors ≤ 10 | 28 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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