5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide

C166H254ClF15N22O34S10 — CID 158216011

IUPAC5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1c(F)cc(F)cc1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cl)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(F)c(F)c1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(OC(F)(F)F)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(F)c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1C(F)(F)F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1F.COc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.C[C@@H]1CN(c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc2F)C[C@H](C)O1.Cc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)ccc1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C22H37N3O4S.C21H34FN3O4S.C16H23F3N2O4S.C16H23F3N2O3S.C16H26N2O4S.C15H23ClN2O3S.2C15H21F3N2O3S.2C15H23FN2O3S/c1-16-13-19(10-11-20(16)25-14-17(2)29-18(3)15-25)24-21(26)9-7-8-12-23-30(27,28)22(4,5)6;1-15-13-25(14-16(2)29-15)19-10-9-17(12-18(19)22)24-20(26)8-6-7-11-23-30(27,28)21(3,4)5;1-15(2,3)26(23,24)20-11-5-4-6-14(22)21-12-7-9-13(10-8-12)25-16(17,18)19;1-15(2,3)25(23,24)20-11-7-6-10-14(22)21-13-9-5-4-8-12(13)16(17,18)19;1-16(2,3)23(20,21)17-12-6-5-7-15(19)18-13-8-10-14(22-4)11-9-13;1-15(2,3)22(20,21)17-11-5-4-6-14(19)18-13-9-7-12(16)8-10-13;1-15(2,3)24(22,23)19-9-5-4-6-12(21)20-11-8-7-10(16)13(17)14(11)18;1-15(2,3)24(22,23)19-7-5-4-6-13(21)20-14-11(17)8-10(16)9-12(14)18;1-15(2,3)22(20,21)17-10-5-4-9-14(19)18-13-8-6-7-12(16)11-13;1-15(2,3)22(20,21)17-11-7-6-10-14(19)18-13-9-5-4-8-12(13)16/h10-11,13,17-18,23H,7-9,12,14-15H2,1-6H3,(H,24,26);9-10,12,15-16,23H,6-8,11,13-14H2,1-5H3,(H,24,26);7-10,20H,4-6,11H2,1-3H3,(H,21,22);4-5,8-9,20H,6-7,10-11H2,1-3H3,(H,21,22);8-11,17H,5-7,12H2,1-4H3,(H,18,19);7-10,17H,4-6,11H2,1-3H3,(H,18,19);7-8,19H,4-6,9H2,1-3H3,(H,20,21);8-9,19H,4-7H2,1-3H3,(H,20,21);6-8,11,17H,4-5,9-10H2,1-3H3,(H,18,19);4-5,8-9,17H,6-7,10-11H2,1-3H3,(H,18,19)/t17-,18+;15-,16+;;;;;;;;
InChIKeyGCQPUCPLOZYTMU-UYZQOPDESA-N
MW3743.07 g/mol
LogP30.50
Rot. Bonds74

About 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide

5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide (PubChem CID 158216011) has the molecular formula C166H254ClF15N22O34S10 and a molecular weight of 3743.07 g/mol. Its IUPAC name is 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide.

Molecular Properties

Compound Name5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide
PubChem CID158216011
Molecular FormulaC166H254ClF15N22O34S10
Molecular Weight3743.07 g/mol
Exact Mass3739.55
IUPAC Name5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1c(F)cc(F)cc1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cl)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(F)c(F)c1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(OC(F)(F)F)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(F)c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1C(F)(F)F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1F.COc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.C[C@@H]1CN(c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc2F)C[C@H](C)O1.Cc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)ccc1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C22H37N3O4S.C21H34FN3O4S.C16H23F3N2O4S.C16H23F3N2O3S.C16H26N2O4S.C15H23ClN2O3S.2C15H21F3N2O3S.2C15H23FN2O3S/c1-16-13-19(10-11-20(16)25-14-17(2)29-18(3)15-25)24-21(26)9-7-8-12-23-30(27,28)22(4,5)6;1-15-13-25(14-16(2)29-15)19-10-9-17(12-18(19)22)24-20(26)8-6-7-11-23-30(27,28)21(3,4)5;1-15(2,3)26(23,24)20-11-5-4-6-14(22)21-12-7-9-13(10-8-12)25-16(17,18)19;1-15(2,3)25(23,24)20-11-7-6-10-14(22)21-13-9-5-4-8-12(13)16(17,18)19;1-16(2,3)23(20,21)17-12-6-5-7-15(19)18-13-8-10-14(22-4)11-9-13;1-15(2,3)22(20,21)17-11-5-4-6-14(19)18-13-9-7-12(16)8-10-13;1-15(2,3)24(22,23)19-9-5-4-6-12(21)20-11-8-7-10(16)13(17)14(11)18;1-15(2,3)24(22,23)19-7-5-4-6-13(21)20-14-11(17)8-10(16)9-12(14)18;1-15(2,3)22(20,21)17-10-5-4-9-14(19)18-13-8-6-7-12(16)11-13;1-15(2,3)22(20,21)17-11-7-6-10-14(19)18-13-9-5-4-8-12(13)16/h10-11,13,17-18,23H,7-9,12,14-15H2,1-6H3,(H,24,26);9-10,12,15-16,23H,6-8,11,13-14H2,1-5H3,(H,24,26);7-10,20H,4-6,11H2,1-3H3,(H,21,22);4-5,8-9,20H,6-7,10-11H2,1-3H3,(H,21,22);8-11,17H,5-7,12H2,1-4H3,(H,18,19);7-10,17H,4-6,11H2,1-3H3,(H,18,19);7-8,19H,4-6,9H2,1-3H3,(H,20,21);8-9,19H,4-7H2,1-3H3,(H,20,21);6-8,11,17H,4-5,9-10H2,1-3H3,(H,18,19);4-5,8-9,17H,6-7,10-11H2,1-3H3,(H,18,19)/t17-,18+;15-,16+;;;;;;;;
InChIKeyGCQPUCPLOZYTMU-UYZQOPDESA-N
XLogP30.50
TPSA796.10 Ų
H-Bond Donors20
H-Bond Acceptors36
Rotatable Bonds74
Heavy Atoms248
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003743.07
LogP ≤ 530.50
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide with MolForge

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Related Compounds

CID 157260091
CID 157260091
CID 157311404
CID 157311404
CID 157344022
CID 157344022
N-(4-butan-2-ylphenyl)-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide;N-(4-tert-butylphenyl)-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-chlorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(2-fluorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(3-fluorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-propan-2-ylphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)cyclohexane-1-carboxamide
CID 157588650
N-[(4-aminocyclohexyl)methyl]-4-tert-butylaniline;N-[(4-aminocyclohexyl)methyl]-4-chloroaniline;N-[(4-aminocyclohexyl)methyl]-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]aniline;N-[(4-aminocyclohexyl)methyl]-2,4,6-trifluoroaniline;N-[4-[(4-methoxyanilino)methyl]cyclohexyl]-2-methylpropane-2-sulfonamide;tetrakis(2-methylpropane-2-sulfinate);2-methyl-N-[4-[[4-(trifluoromethoxy)anilino]methyl]cyclohexyl]propane-2-sulfonamide
CID 157734826
N-[(4-aminocyclohexyl)methyl]-4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3,5-dimethylaniline;N-[(4-aminocyclohexyl)methyl]-4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-fluoro-5-methylaniline;N-[(4-aminocyclohexyl)methyl]-2-fluoroaniline;N-[(4-aminocyclohexyl)methyl]-3-fluoroaniline;N-[(4-aminocyclohexyl)methyl]-4-(trifluoromethoxy)aniline;pentakis(propane-2-sulfinate);N-[4-[(2,4,6-trifluoroanilino)methyl]cyclohexyl]propane-2-sulfonamide
CID 157750934
N-(4-tert-butylphenyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide
CID 157760803
CID 158317709
CID 158317709
CID 158425659
CID 158425659
N-(4-butan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-tert-butylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-chlorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-methoxyphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-methylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-phenyl-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-propan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide
CID 158873175
CID 158912446
CID 158912446
N'-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentane-1,5-diamine;N'-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentane-1,5-diamine;N-[5-(2-fluoroanilino)pentyl]propane-2-sulfonamide;N'-(3-fluorophenyl)pentane-1,5-diamine;N'-(4-methoxyphenyl)pentane-1,5-diamine;heptakis(propane-2-sulfinate);N'-[4-(trifluoromethoxy)phenyl]pentane-1,5-diamine;N'-[2-(trifluoromethyl)phenyl]pentane-1,5-diamine;N'-(2,4,6-trifluorophenyl)pentane-1,5-diamine
CID 159350755

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide?
The IUPAC name of 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide (CID 158216011) is 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide.
What is the SMILES notation for 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide?
The canonical SMILES for 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide is CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1c(F)cc(F)cc1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cl)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(F)c(F)c1F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(OC(F)(F)F)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(F)c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1C(F)(F)F.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccccc1F.COc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.C[C@@H]1CN(c2ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc2F)C[C@H](C)O1.Cc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)ccc1N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide?
The InChIKey is GCQPUCPLOZYTMU-UYZQOPDESA-N. The full InChI is InChI=1S/C22H37N3O4S.C21H34FN3O4S.C16H23F3N2O4S.C16H23F3N2O3S.C16H26N2O4S.C15H23ClN2O3S.2C15H21F3N2O3S.2C15H23FN2O3S/c1-16-13-19(10-11-20(16)25-14-17(2)29-18(3)15-25)24-21(26)9-7-8-12-23-30(27,28)22(4,5)6;1-15-13-25(14-16(2)29-15)19-10-9-17(12-18(19)22)24-20(26)8-6-7-11-23-30(27,28)21(3,4)5;1-15(2,3)26(23,24)20-11-5-4-6-14(22)21-12-7-9-13(10-8-12)25-16(17,18)19;1-15(2,3)25(23,24)20-11-7-6-10-14(22)21-13-9-5-4-8-12(13)16(17,18)19;1-16(2,3)23(20,21)17-12-6-5-7-15(19)18-13-8-10-14(22-4)11-9-13;1-15(2,3)22(20,21)17-11-5-4-6-14(19)18-13-9-7-12(16)8-10-13;1-15(2,3)24(22,23)19-9-5-4-6-12(21)20-11-8-7-10(16)13(17)14(11)18;1-15(2,3)24(22,23)19-7-5-4-6-13(21)20-14-11(17)8-10(16)9-12(14)18;1-15(2,3)22(20,21)17-10-5-4-9-14(19)18-13-8-6-7-12(16)11-13;1-15(2,3)22(20,21)17-11-7-6-10-14(19)18-13-9-5-4-8-12(13)16/h10-11,13,17-18,23H,7-9,12,14-15H2,1-6H3,(H,24,26);9-10,12,15-16,23H,6-8,11,13-14H2,1-5H3,(H,24,26);7-10,20H,4-6,11H2,1-3H3,(H,21,22);4-5,8-9,20H,6-7,10-11H2,1-3H3,(H,21,22);8-11,17H,5-7,12H2,1-4H3,(H,18,19);7-10,17H,4-6,11H2,1-3H3,(H,18,19);7-8,19H,4-6,9H2,1-3H3,(H,20,21);8-9,19H,4-7H2,1-3H3,(H,20,21);6-8,11,17H,4-5,9-10H2,1-3H3,(H,18,19);4-5,8-9,17H,6-7,10-11H2,1-3H3,(H,18,19)/t17-,18+;15-,16+;;;;;;;;.
What are the key properties of 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide?
5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide has a molecular weight of 3743.07 g/mol, XLogP of 30.50, 74 rotatable bonds, 20 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylsulfonylamino)-N-(4-chlorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-fluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-(trifluoromethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(2,3,4-trifluorophenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)pentanamide is sourced from PubChem (CID 158216011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).