N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate

C258H420N36O61S14 — CID 158337080

IUPACN-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Oc2ccccc2)nc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(O)c1.CCCCCc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(N)c1.CCCCOc1cc(C)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(O)c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c([N+](=O)[O-])c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1O.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cn1.CCCCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.CCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COC(=O)Cc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.Cc1cc(Oc2ccccc2)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1
InChIInChI=1S/C20H28N4O4S.C20H27N3O4S.C20H35N3O3S.C19H31N3O6S.2C19H32N2O5S.2C19H32N2O4S.C18H32N4O4S.C18H31N3O4S.C18H28N2O5S.C17H28N2O5S.C17H28N2O4S.C15H24N2O4S/c1-15-14-18(28-16-10-6-5-7-11-16)24-19(22-15)23-17(25)12-8-9-13-21-29(26,27)20(2,3)4;1-20(2,3)28(25,26)22-14-8-7-11-18(24)23-16-12-13-19(21-15-16)27-17-9-5-4-6-10-17;1-5-6-7-10-16-12-13-18(17(21)15-16)23-19(24)11-8-9-14-22-27(25,26)20(2,3)4;1-5-6-13-28-15-10-11-16(17(14-15)22(24)25)21-18(23)9-7-8-12-20-29(26,27)19(2,3)4;1-5-6-13-26-17-11-10-15(14-16(17)22)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-13-26-15-10-11-16(17(22)14-15)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-14-25-17-11-9-10-16(15-17)21-18(22)12-7-8-13-20-26(23,24)19(2,3)4;1-5-6-15-25-17-12-10-16(11-13-17)21-18(22)9-7-8-14-20-26(23,24)19(2,3)4;1-6-7-12-26-16-13-14(2)20-17(22-16)21-15(23)10-8-9-11-19-27(24,25)18(3,4)5;1-5-6-13-25-17-11-10-15(14-19-17)21-16(22)9-7-8-12-20-26(23,24)18(2,3)4;1-18(2,3)26(23,24)19-11-6-5-10-16(21)20-15-9-7-8-14(12-15)13-17(22)25-4;1-17(2,3)25(21,22)18-11-6-5-10-16(20)19-14-8-7-9-15(12-14)24-13-23-4;1-5-23-15-10-8-9-14(13-15)19-16(20)11-6-7-12-18-24(21,22)17(2,3)4;1-15(2,3)22(20,21)16-10-5-4-9-14(19)17-12-7-6-8-13(18)11-12/h5-7,10-11,14,21H,8-9,12-13H2,1-4H3,(H,22,23,24,25);4-6,9-10,12-13,15,22H,7-8,11,14H2,1-3H3,(H,23,24);12-13,15,22H,5-11,14,21H2,1-4H3,(H,23,24);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,23);2*10-11,14,20,22H,5-9,12-13H2,1-4H3,(H,21,23);9-11,15,20H,5-8,12-14H2,1-4H3,(H,21,22);10-13,20H,5-9,14-15H2,1-4H3,(H,21,22);13,19H,6-12H2,1-5H3,(H,20,21,22,23);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,22);7-9,12,19H,5-6,10-11,13H2,1-4H3,(H,20,21);7-9,12,18H,5-6,10-11,13H2,1-4H3,(H,19,20);8-10,13,18H,5-7,11-12H2,1-4H3,(H,19,20);6-8,11,16,18H,4-5,9-10H2,1-3H3,(H,17,19)
InChIKeyGQSDZMNJPCGRSV-UHFFFAOYSA-N
MW5451.33 g/mol
LogP44.45
Rot. Bonds142

About N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate

N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate (PubChem CID 158337080) has the molecular formula C258H420N36O61S14 and a molecular weight of 5451.33 g/mol. Its IUPAC name is N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate.

Molecular Properties

Compound NameN-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate
PubChem CID158337080
Molecular FormulaC258H420N36O61S14
Molecular Weight5451.33 g/mol
Exact Mass5446.70
IUPAC NameN-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Oc2ccccc2)nc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(O)c1.CCCCCc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(N)c1.CCCCOc1cc(C)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(O)c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c([N+](=O)[O-])c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1O.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cn1.CCCCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.CCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COC(=O)Cc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.Cc1cc(Oc2ccccc2)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1
InChIInChI=1S/C20H28N4O4S.C20H27N3O4S.C20H35N3O3S.C19H31N3O6S.2C19H32N2O5S.2C19H32N2O4S.C18H32N4O4S.C18H31N3O4S.C18H28N2O5S.C17H28N2O5S.C17H28N2O4S.C15H24N2O4S/c1-15-14-18(28-16-10-6-5-7-11-16)24-19(22-15)23-17(25)12-8-9-13-21-29(26,27)20(2,3)4;1-20(2,3)28(25,26)22-14-8-7-11-18(24)23-16-12-13-19(21-15-16)27-17-9-5-4-6-10-17;1-5-6-7-10-16-12-13-18(17(21)15-16)23-19(24)11-8-9-14-22-27(25,26)20(2,3)4;1-5-6-13-28-15-10-11-16(17(14-15)22(24)25)21-18(23)9-7-8-12-20-29(26,27)19(2,3)4;1-5-6-13-26-17-11-10-15(14-16(17)22)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-13-26-15-10-11-16(17(22)14-15)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-14-25-17-11-9-10-16(15-17)21-18(22)12-7-8-13-20-26(23,24)19(2,3)4;1-5-6-15-25-17-12-10-16(11-13-17)21-18(22)9-7-8-14-20-26(23,24)19(2,3)4;1-6-7-12-26-16-13-14(2)20-17(22-16)21-15(23)10-8-9-11-19-27(24,25)18(3,4)5;1-5-6-13-25-17-11-10-15(14-19-17)21-16(22)9-7-8-12-20-26(23,24)18(2,3)4;1-18(2,3)26(23,24)19-11-6-5-10-16(21)20-15-9-7-8-14(12-15)13-17(22)25-4;1-17(2,3)25(21,22)18-11-6-5-10-16(20)19-14-8-7-9-15(12-14)24-13-23-4;1-5-23-15-10-8-9-14(13-15)19-16(20)11-6-7-12-18-24(21,22)17(2,3)4;1-15(2,3)22(20,21)16-10-5-4-9-14(19)17-12-7-6-8-13(18)11-12/h5-7,10-11,14,21H,8-9,12-13H2,1-4H3,(H,22,23,24,25);4-6,9-10,12-13,15,22H,7-8,11,14H2,1-3H3,(H,23,24);12-13,15,22H,5-11,14,21H2,1-4H3,(H,23,24);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,23);2*10-11,14,20,22H,5-9,12-13H2,1-4H3,(H,21,23);9-11,15,20H,5-8,12-14H2,1-4H3,(H,21,22);10-13,20H,5-9,14-15H2,1-4H3,(H,21,22);13,19H,6-12H2,1-5H3,(H,20,21,22,23);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,22);7-9,12,19H,5-6,10-11,13H2,1-4H3,(H,20,21);7-9,12,18H,5-6,10-11,13H2,1-4H3,(H,19,20);8-10,13,18H,5-7,11-12H2,1-4H3,(H,19,20);6-8,11,16,18H,4-5,9-10H2,1-3H3,(H,17,19)
InChIKeyGQSDZMNJPCGRSV-UHFFFAOYSA-N
XLogP44.45
TPSA1398.03 Ų
H-Bond Donors32
H-Bond Acceptors68
Rotatable Bonds142
Heavy Atoms369
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005451.33
LogP ≤ 544.45
H-Bond Donors ≤ 532
H-Bond Acceptors ≤ 1068

Analyze N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate?
The IUPAC name of N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate (CID 158337080) is N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate.
What is the SMILES notation for N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate?
The canonical SMILES for N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate is CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Oc2ccccc2)nc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc(O)c1.CCCCCc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(N)c1.CCCCOc1cc(C)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c(O)c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c([N+](=O)[O-])c1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc1O.CCCCOc1ccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cn1.CCCCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.CCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COC(=O)Cc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COCOc1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.Cc1cc(Oc2ccccc2)nc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)n1.
What is the InChIKey of N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate?
The InChIKey is GQSDZMNJPCGRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O4S.C20H27N3O4S.C20H35N3O3S.C19H31N3O6S.2C19H32N2O5S.2C19H32N2O4S.C18H32N4O4S.C18H31N3O4S.C18H28N2O5S.C17H28N2O5S.C17H28N2O4S.C15H24N2O4S/c1-15-14-18(28-16-10-6-5-7-11-16)24-19(22-15)23-17(25)12-8-9-13-21-29(26,27)20(2,3)4;1-20(2,3)28(25,26)22-14-8-7-11-18(24)23-16-12-13-19(21-15-16)27-17-9-5-4-6-10-17;1-5-6-7-10-16-12-13-18(17(21)15-16)23-19(24)11-8-9-14-22-27(25,26)20(2,3)4;1-5-6-13-28-15-10-11-16(17(14-15)22(24)25)21-18(23)9-7-8-12-20-29(26,27)19(2,3)4;1-5-6-13-26-17-11-10-15(14-16(17)22)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-13-26-15-10-11-16(17(22)14-15)21-18(23)9-7-8-12-20-27(24,25)19(2,3)4;1-5-6-14-25-17-11-9-10-16(15-17)21-18(22)12-7-8-13-20-26(23,24)19(2,3)4;1-5-6-15-25-17-12-10-16(11-13-17)21-18(22)9-7-8-14-20-26(23,24)19(2,3)4;1-6-7-12-26-16-13-14(2)20-17(22-16)21-15(23)10-8-9-11-19-27(24,25)18(3,4)5;1-5-6-13-25-17-11-10-15(14-19-17)21-16(22)9-7-8-12-20-26(23,24)18(2,3)4;1-18(2,3)26(23,24)19-11-6-5-10-16(21)20-15-9-7-8-14(12-15)13-17(22)25-4;1-17(2,3)25(21,22)18-11-6-5-10-16(20)19-14-8-7-9-15(12-14)24-13-23-4;1-5-23-15-10-8-9-14(13-15)19-16(20)11-6-7-12-18-24(21,22)17(2,3)4;1-15(2,3)22(20,21)16-10-5-4-9-14(19)17-12-7-6-8-13(18)11-12/h5-7,10-11,14,21H,8-9,12-13H2,1-4H3,(H,22,23,24,25);4-6,9-10,12-13,15,22H,7-8,11,14H2,1-3H3,(H,23,24);12-13,15,22H,5-11,14,21H2,1-4H3,(H,23,24);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,23);2*10-11,14,20,22H,5-9,12-13H2,1-4H3,(H,21,23);9-11,15,20H,5-8,12-14H2,1-4H3,(H,21,22);10-13,20H,5-9,14-15H2,1-4H3,(H,21,22);13,19H,6-12H2,1-5H3,(H,20,21,22,23);10-11,14,20H,5-9,12-13H2,1-4H3,(H,21,22);7-9,12,19H,5-6,10-11,13H2,1-4H3,(H,20,21);7-9,12,18H,5-6,10-11,13H2,1-4H3,(H,19,20);8-10,13,18H,5-7,11-12H2,1-4H3,(H,19,20);6-8,11,16,18H,4-5,9-10H2,1-3H3,(H,17,19).
What are the key properties of N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate?
N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate has a molecular weight of 5451.33 g/mol, XLogP of 44.45, 142 rotatable bonds, 32 hydrogen bond donors, and 68 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-pentylphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-3-hydroxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-6-methylpyrimidin-2-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxy-2-nitrophenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(3-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(4-butoxyphenyl)-5-(tert-butylsulfonylamino)pentanamide;N-(6-butoxy-3-pyridinyl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-(3-ethoxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-(3-hydroxyphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[3-(methoxymethoxy)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(4-methyl-6-phenoxypyrimidin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(6-phenoxy-3-pyridinyl)pentanamide;methyl 2-[3-[5-(tert-butylsulfonylamino)pentanoylamino]phenyl]acetate is sourced from PubChem (CID 158337080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).