N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide

C276H410F4N48O55S22 — CID 160632467

IUPACN-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2ccccc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cc2ccncc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(N2CC=CC2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ncsc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ocnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2sccc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2scnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2c1Cc1ccccc1-2.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2nsnc12.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncccn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncncn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1nnc(-c2ccc(F)cc2)s1.CC(C)NC(=O)c1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)CCCCNS(=O)(=O)C(C)(C)C
InChIInChI=1S/C22H28N2O3S.C21H29N3O3S.C21H28N2O3S.C19H31N3O4S.C19H29N3O3S.C18H30N2O6S.C17H25F3N2O3S.C17H23FN4O3S2.C17H29N3O5S2.C17H24N2O3S2.C16H23N3O4S.2C16H23N3O3S2.C15H22N4O3S2.C13H22N4O3S.C12H21N5O3S/c1-22(2,3)28(26,27)23-14-7-6-13-21(25)24-20-12-8-11-18-17-10-5-4-9-16(17)15-19(18)20;1-21(2,3)28(26,27)23-13-5-4-6-20(25)24-19-9-7-17(8-10-19)16-18-11-14-22-15-12-18;1-21(2,3)27(25,26)22-16-8-7-11-20(24)23-19-14-12-18(13-15-19)17-9-5-4-6-10-17;1-14(2)21-18(24)15-9-8-10-16(13-15)22-17(23)11-6-7-12-20-27(25,26)19(3,4)5;1-19(2,3)26(24,25)20-13-5-4-8-18(23)21-16-9-11-17(12-10-16)22-14-6-7-15-22;1-18(2,3)27(22,23)19-10-8-7-9-16(21)20-13-11-14(24-4)17(26-6)15(12-13)25-5;1-12-11-13(17(18,19)20)8-9-14(12)22-15(23)7-5-6-10-21-26(24,25)16(2,3)4;1-17(2,3)27(24,25)19-11-5-4-6-14(23)20-16-22-21-15(26-16)12-7-9-13(18)10-8-12;1-17(2,3)27(24,25)20-12-5-4-6-16(21)19-13-11-14-7-9-15(10-8-14)26(18,22)23;1-17(2,3)24(21,22)18-10-5-4-6-16(20)19-14-7-8-15-13(12-14)9-11-23-15;2*1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-14-13(10-12)17-11-23-14;1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-13-14(10-12)23-11-17-13;1-15(2,3)24(21,22)16-10-5-4-9-13(20)17-11-7-6-8-12-14(11)19-23-18-12;1-13(2,3)21(19,20)16-10-5-4-7-11(18)17-12-14-8-6-9-15-12;1-12(2,3)21(19,20)16-7-5-4-6-10(18)17-11-14-8-13-9-15-11/h4-5,8-12,23H,6-7,13-15H2,1-3H3,(H,24,25);7-12,14-15,23H,4-6,13,16H2,1-3H3,(H,24,25);4-6,9-10,12-15,22H,7-8,11,16H2,1-3H3,(H,23,24);8-10,13-14,20H,6-7,11-12H2,1-5H3,(H,21,24)(H,22,23);6-7,9-12,20H,4-5,8,13-15H2,1-3H3,(H,21,23);11-12,19H,7-10H2,1-6H3,(H,20,21);8-9,11,21H,5-7,10H2,1-4H3,(H,22,23);7-10,19H,4-6,11H2,1-3H3,(H,20,22,23);7-10,20H,4-6,11-13H2,1-3H3,(H,19,21)(H2,18,22,23);7-9,11-12,18H,4-6,10H2,1-3H3,(H,19,20);3*7-8,10-11,18H,4-6,9H2,1-3H3,(H,19,20);6-8,16H,4-5,9-10H2,1-3H3,(H,17,20);6,8-9,16H,4-5,7,10H2,1-3H3,(H,14,15,17,18);8-9,16H,4-7H2,1-3H3,(H,13,14,15,17,18)
InChIKeyRICBPIGWMQXXGY-UHFFFAOYSA-N
MW6062.06 g/mol
LogP44.88
Rot. Bonds125

About N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide

N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide (PubChem CID 160632467) has the molecular formula C276H410F4N48O55S22 and a molecular weight of 6062.06 g/mol. Its IUPAC name is N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide.

Molecular Properties

Compound NameN-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide
PubChem CID160632467
Molecular FormulaC276H410F4N48O55S22
Molecular Weight6062.06 g/mol
Exact Mass6056.46
IUPAC NameN-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide
SMILESCC(C)(C)S(=O)(=O)NCCCCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2ccccc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cc2ccncc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(N2CC=CC2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ncsc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ocnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2sccc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2scnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2c1Cc1ccccc1-2.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2nsnc12.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncccn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncncn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1nnc(-c2ccc(F)cc2)s1.CC(C)NC(=O)c1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)CCCCNS(=O)(=O)C(C)(C)C
InChIInChI=1S/C22H28N2O3S.C21H29N3O3S.C21H28N2O3S.C19H31N3O4S.C19H29N3O3S.C18H30N2O6S.C17H25F3N2O3S.C17H23FN4O3S2.C17H29N3O5S2.C17H24N2O3S2.C16H23N3O4S.2C16H23N3O3S2.C15H22N4O3S2.C13H22N4O3S.C12H21N5O3S/c1-22(2,3)28(26,27)23-14-7-6-13-21(25)24-20-12-8-11-18-17-10-5-4-9-16(17)15-19(18)20;1-21(2,3)28(26,27)23-13-5-4-6-20(25)24-19-9-7-17(8-10-19)16-18-11-14-22-15-12-18;1-21(2,3)27(25,26)22-16-8-7-11-20(24)23-19-14-12-18(13-15-19)17-9-5-4-6-10-17;1-14(2)21-18(24)15-9-8-10-16(13-15)22-17(23)11-6-7-12-20-27(25,26)19(3,4)5;1-19(2,3)26(24,25)20-13-5-4-8-18(23)21-16-9-11-17(12-10-16)22-14-6-7-15-22;1-18(2,3)27(22,23)19-10-8-7-9-16(21)20-13-11-14(24-4)17(26-6)15(12-13)25-5;1-12-11-13(17(18,19)20)8-9-14(12)22-15(23)7-5-6-10-21-26(24,25)16(2,3)4;1-17(2,3)27(24,25)19-11-5-4-6-14(23)20-16-22-21-15(26-16)12-7-9-13(18)10-8-12;1-17(2,3)27(24,25)20-12-5-4-6-16(21)19-13-11-14-7-9-15(10-8-14)26(18,22)23;1-17(2,3)24(21,22)18-10-5-4-6-16(20)19-14-7-8-15-13(12-14)9-11-23-15;2*1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-14-13(10-12)17-11-23-14;1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-13-14(10-12)23-11-17-13;1-15(2,3)24(21,22)16-10-5-4-9-13(20)17-11-7-6-8-12-14(11)19-23-18-12;1-13(2,3)21(19,20)16-10-5-4-7-11(18)17-12-14-8-6-9-15-12;1-12(2,3)21(19,20)16-7-5-4-6-10(18)17-11-14-8-13-9-15-11/h4-5,8-12,23H,6-7,13-15H2,1-3H3,(H,24,25);7-12,14-15,23H,4-6,13,16H2,1-3H3,(H,24,25);4-6,9-10,12-15,22H,7-8,11,16H2,1-3H3,(H,23,24);8-10,13-14,20H,6-7,11-12H2,1-5H3,(H,21,24)(H,22,23);6-7,9-12,20H,4-5,8,13-15H2,1-3H3,(H,21,23);11-12,19H,7-10H2,1-6H3,(H,20,21);8-9,11,21H,5-7,10H2,1-4H3,(H,22,23);7-10,19H,4-6,11H2,1-3H3,(H,20,22,23);7-10,20H,4-6,11-13H2,1-3H3,(H,19,21)(H2,18,22,23);7-9,11-12,18H,4-6,10H2,1-3H3,(H,19,20);3*7-8,10-11,18H,4-6,9H2,1-3H3,(H,19,20);6-8,16H,4-5,9-10H2,1-3H3,(H,17,20);6,8-9,16H,4-5,7,10H2,1-3H3,(H,14,15,17,18);8-9,16H,4-7H2,1-3H3,(H,13,14,15,17,18)
InChIKeyRICBPIGWMQXXGY-UHFFFAOYSA-N
XLogP44.88
TPSA1505.22 Ų
H-Bond Donors34
H-Bond Acceptors74
Rotatable Bonds125
Heavy Atoms405
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006062.06
LogP ≤ 544.88
H-Bond Donors ≤ 534
H-Bond Acceptors ≤ 1074

Analyze N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide with MolForge

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What is the IUPAC name of N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide?
The IUPAC name of N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide (CID 160632467) is N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide.
What is the SMILES notation for N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide?
The canonical SMILES for N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide is CC(C)(C)S(=O)(=O)NCCCCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(-c2ccccc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(Cc2ccncc2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc(N2CC=CC2)cc1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ncsc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2ocnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2sccc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ccc2scnc2c1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2c1Cc1ccccc1-2.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1cccc2nsnc12.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncccn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1ncncn1.CC(C)(C)S(=O)(=O)NCCCCC(=O)Nc1nnc(-c2ccc(F)cc2)s1.CC(C)NC(=O)c1cccc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)c1.COc1cc(NC(=O)CCCCNS(=O)(=O)C(C)(C)C)cc(OC)c1OC.Cc1cc(C(F)(F)F)ccc1NC(=O)CCCCNS(=O)(=O)C(C)(C)C.
What is the InChIKey of N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide?
The InChIKey is RICBPIGWMQXXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3S.C21H29N3O3S.C21H28N2O3S.C19H31N3O4S.C19H29N3O3S.C18H30N2O6S.C17H25F3N2O3S.C17H23FN4O3S2.C17H29N3O5S2.C17H24N2O3S2.C16H23N3O4S.2C16H23N3O3S2.C15H22N4O3S2.C13H22N4O3S.C12H21N5O3S/c1-22(2,3)28(26,27)23-14-7-6-13-21(25)24-20-12-8-11-18-17-10-5-4-9-16(17)15-19(18)20;1-21(2,3)28(26,27)23-13-5-4-6-20(25)24-19-9-7-17(8-10-19)16-18-11-14-22-15-12-18;1-21(2,3)27(25,26)22-16-8-7-11-20(24)23-19-14-12-18(13-15-19)17-9-5-4-6-10-17;1-14(2)21-18(24)15-9-8-10-16(13-15)22-17(23)11-6-7-12-20-27(25,26)19(3,4)5;1-19(2,3)26(24,25)20-13-5-4-8-18(23)21-16-9-11-17(12-10-16)22-14-6-7-15-22;1-18(2,3)27(22,23)19-10-8-7-9-16(21)20-13-11-14(24-4)17(26-6)15(12-13)25-5;1-12-11-13(17(18,19)20)8-9-14(12)22-15(23)7-5-6-10-21-26(24,25)16(2,3)4;1-17(2,3)27(24,25)19-11-5-4-6-14(23)20-16-22-21-15(26-16)12-7-9-13(18)10-8-12;1-17(2,3)27(24,25)20-12-5-4-6-16(21)19-13-11-14-7-9-15(10-8-14)26(18,22)23;1-17(2,3)24(21,22)18-10-5-4-6-16(20)19-14-7-8-15-13(12-14)9-11-23-15;2*1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-14-13(10-12)17-11-23-14;1-16(2,3)24(21,22)18-9-5-4-6-15(20)19-12-7-8-13-14(10-12)23-11-17-13;1-15(2,3)24(21,22)16-10-5-4-9-13(20)17-11-7-6-8-12-14(11)19-23-18-12;1-13(2,3)21(19,20)16-10-5-4-7-11(18)17-12-14-8-6-9-15-12;1-12(2,3)21(19,20)16-7-5-4-6-10(18)17-11-14-8-13-9-15-11/h4-5,8-12,23H,6-7,13-15H2,1-3H3,(H,24,25);7-12,14-15,23H,4-6,13,16H2,1-3H3,(H,24,25);4-6,9-10,12-15,22H,7-8,11,16H2,1-3H3,(H,23,24);8-10,13-14,20H,6-7,11-12H2,1-5H3,(H,21,24)(H,22,23);6-7,9-12,20H,4-5,8,13-15H2,1-3H3,(H,21,23);11-12,19H,7-10H2,1-6H3,(H,20,21);8-9,11,21H,5-7,10H2,1-4H3,(H,22,23);7-10,19H,4-6,11H2,1-3H3,(H,20,22,23);7-10,20H,4-6,11-13H2,1-3H3,(H,19,21)(H2,18,22,23);7-9,11-12,18H,4-6,10H2,1-3H3,(H,19,20);3*7-8,10-11,18H,4-6,9H2,1-3H3,(H,19,20);6-8,16H,4-5,9-10H2,1-3H3,(H,17,20);6,8-9,16H,4-5,7,10H2,1-3H3,(H,14,15,17,18);8-9,16H,4-7H2,1-3H3,(H,13,14,15,17,18).
What are the key properties of N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide?
N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide has a molecular weight of 6062.06 g/mol, XLogP of 44.88, 125 rotatable bonds, 34 hydrogen bond donors, and 74 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,1,3-benzothiadiazol-4-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzothiazol-6-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1-benzothiophen-5-yl)-5-(tert-butylsulfonylamino)pentanamide;N-(1,3-benzoxazol-5-yl)-5-(tert-butylsulfonylamino)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(2,5-dihydropyrrol-1-yl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-(9H-fluoren-1-yl)pentanamide;5-(tert-butylsulfonylamino)-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]pentanamide;5-(tert-butylsulfonylamino)-N-[2-methyl-4-(trifluoromethyl)phenyl]pentanamide;3-[5-(tert-butylsulfonylamino)pentanoylamino]-N-propan-2-ylbenzamide;5-(tert-butylsulfonylamino)-N-(4-phenylphenyl)pentanamide;5-(tert-butylsulfonylamino)-N-[4-(pyridin-4-ylmethyl)phenyl]pentanamide;5-(tert-butylsulfonylamino)-N-pyrimidin-2-ylpentanamide;5-(tert-butylsulfonylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pentanamide;5-(tert-butylsulfonylamino)-N-(1,3,5-triazin-2-yl)pentanamide;5-(tert-butylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)pentanamide is sourced from PubChem (CID 160632467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).