(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide

C253H224ClF10N35O41S4 — CID 158752443

IUPAC(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide
SMILESCC(=O)C(=O)C(C)NC(=O)c1nsnc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1c(C(F)(F)F)ccc(Cl)c1F.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cc(C)nn1-c1ccccn1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C(F)F)nc1-c1cccc2cnccc12.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C)nc1-c1ccoc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C2CC2)nc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1cccc2c1OC(F)(F)O2.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1cccc(F)c1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1ccccc1F.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1Cc1ccccc1.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1.O=CC(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1
InChIInChI=1S/C25H20F2N4O3.C25H27N3O4.C24H23N3O3.2C22H19FN2O4.C22H20N4O3S.C21H15F2N3O5S.C21H20N4O3.C20H19N3O4.C19H14ClF4NO3.C18H15N3O2S.C14H13N3O3S/c1-15(32)23(33)21(12-16-6-3-2-4-7-16)29-24(34)20-14-31(25(26)27)30-22(20)19-9-5-8-17-13-28-11-10-18(17)19;29-22-14-13-21(28(22)16-18-9-5-2-6-10-18)24(31)27-20(15-17-7-3-1-4-8-17)23(30)25(32)26-19-11-12-19;1-16(28)23(29)21(14-17-8-4-2-5-9-17)25-24(30)20-15-27(19-12-13-19)26-22(20)18-10-6-3-7-11-18;1-13(26)20(27)18(12-15-8-4-3-5-9-15)25-22(28)21-19(24-14(2)29-21)16-10-6-7-11-17(16)23;1-13(26)20(27)18(11-15-7-4-3-5-8-15)25-22(28)21-19(24-14(2)29-21)16-9-6-10-17(23)12-16;27-20(22(29)23-16-11-12-16)17(13-14-7-3-1-4-8-14)24-21(28)19-18(25-30-26-19)15-9-5-2-6-10-15;1-11(27)18(28)14(10-12-6-3-2-4-7-12)24-20(29)17-16(25-32-26-17)13-8-5-9-15-19(13)31-21(22,23)30-15;1-14-12-18(25(24-14)19-10-6-7-11-22-19)21(28)23-17(20(27)15(2)26)13-16-8-4-3-5-9-16;1-13(24)19(25)17(10-14-6-4-3-5-7-14)21-20(26)16-11-23(2)22-18(16)15-8-9-27-12-15;1-10(26)17(27)14(9-11-5-3-2-4-6-11)25-18(28)15-12(19(22,23)24)7-8-13(20)16(15)21;22-12-15(11-13-7-3-1-4-8-13)19-18(23)17-16(20-24-21-17)14-9-5-2-6-10-14;1-8(13(19)9(2)18)15-14(20)12-11(16-21-17-12)10-6-4-3-5-7-10/h2-11,13-14,21,25H,12H2,1H3,(H,29,34);1-10,19-21H,11-16H2,(H,26,32)(H,27,31);2-11,15,19,21H,12-14H2,1H3,(H,25,30);3-11,18H,12H2,1-2H3,(H,25,28);3-10,12,18H,11H2,1-2H3,(H,25,28);1-10,16-17H,11-13H2,(H,23,29)(H,24,28);2-9,14H,10H2,1H3,(H,24,29);3-12,17H,13H2,1-2H3,(H,23,28);3-9,11-12,17H,10H2,1-2H3,(H,21,26);2-8,14H,9H2,1H3,(H,25,28);1-10,12,15H,11H2,(H,19,23);3-8H,1-2H3,(H,15,20)/t;20?,21-;;;;;;;;;;/m.1........../s1
InChIKeyINQOJIASAHEVAC-NHMKFPFNSA-N
MW4764.48 g/mol
LogP33.60
Rot. Bonds85

About (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide

(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide (PubChem CID 158752443) has the molecular formula C253H224ClF10N35O41S4 and a molecular weight of 4764.48 g/mol. Its IUPAC name is (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide.

Molecular Properties

Compound Name(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide
PubChem CID158752443
Molecular FormulaC253H224ClF10N35O41S4
Molecular Weight4764.48 g/mol
Exact Mass4760.49
IUPAC Name(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide
SMILESCC(=O)C(=O)C(C)NC(=O)c1nsnc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1c(C(F)(F)F)ccc(Cl)c1F.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cc(C)nn1-c1ccccn1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C(F)F)nc1-c1cccc2cnccc12.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C)nc1-c1ccoc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C2CC2)nc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1cccc2c1OC(F)(F)O2.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1cccc(F)c1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1ccccc1F.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1Cc1ccccc1.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1.O=CC(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1
InChIInChI=1S/C25H20F2N4O3.C25H27N3O4.C24H23N3O3.2C22H19FN2O4.C22H20N4O3S.C21H15F2N3O5S.C21H20N4O3.C20H19N3O4.C19H14ClF4NO3.C18H15N3O2S.C14H13N3O3S/c1-15(32)23(33)21(12-16-6-3-2-4-7-16)29-24(34)20-14-31(25(26)27)30-22(20)19-9-5-8-17-13-28-11-10-18(17)19;29-22-14-13-21(28(22)16-18-9-5-2-6-10-18)24(31)27-20(15-17-7-3-1-4-8-17)23(30)25(32)26-19-11-12-19;1-16(28)23(29)21(14-17-8-4-2-5-9-17)25-24(30)20-15-27(19-12-13-19)26-22(20)18-10-6-3-7-11-18;1-13(26)20(27)18(12-15-8-4-3-5-9-15)25-22(28)21-19(24-14(2)29-21)16-10-6-7-11-17(16)23;1-13(26)20(27)18(11-15-7-4-3-5-8-15)25-22(28)21-19(24-14(2)29-21)16-9-6-10-17(23)12-16;27-20(22(29)23-16-11-12-16)17(13-14-7-3-1-4-8-14)24-21(28)19-18(25-30-26-19)15-9-5-2-6-10-15;1-11(27)18(28)14(10-12-6-3-2-4-7-12)24-20(29)17-16(25-32-26-17)13-8-5-9-15-19(13)31-21(22,23)30-15;1-14-12-18(25(24-14)19-10-6-7-11-22-19)21(28)23-17(20(27)15(2)26)13-16-8-4-3-5-9-16;1-13(24)19(25)17(10-14-6-4-3-5-7-14)21-20(26)16-11-23(2)22-18(16)15-8-9-27-12-15;1-10(26)17(27)14(9-11-5-3-2-4-6-11)25-18(28)15-12(19(22,23)24)7-8-13(20)16(15)21;22-12-15(11-13-7-3-1-4-8-13)19-18(23)17-16(20-24-21-17)14-9-5-2-6-10-14;1-8(13(19)9(2)18)15-14(20)12-11(16-21-17-12)10-6-4-3-5-7-10/h2-11,13-14,21,25H,12H2,1H3,(H,29,34);1-10,19-21H,11-16H2,(H,26,32)(H,27,31);2-11,15,19,21H,12-14H2,1H3,(H,25,30);3-11,18H,12H2,1-2H3,(H,25,28);3-10,12,18H,11H2,1-2H3,(H,25,28);1-10,16-17H,11-13H2,(H,23,29)(H,24,28);2-9,14H,10H2,1H3,(H,24,29);3-12,17H,13H2,1-2H3,(H,23,28);3-9,11-12,17H,10H2,1-2H3,(H,21,26);2-8,14H,9H2,1H3,(H,25,28);1-10,12,15H,11H2,(H,19,23);3-8H,1-2H3,(H,15,20)/t;20?,21-;;;;;;;;;;/m.1........../s1
InChIKeyINQOJIASAHEVAC-NHMKFPFNSA-N
XLogP33.60
TPSA1070.02 Ų
H-Bond Donors14
H-Bond Acceptors65
Rotatable Bonds85
Heavy Atoms344
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004764.48
LogP ≤ 533.60
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1065

Analyze (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide with MolForge

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What is the IUPAC name of (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide?
The IUPAC name of (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide (CID 158752443) is (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide.
What is the SMILES notation for (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide?
The canonical SMILES for (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide is CC(=O)C(=O)C(C)NC(=O)c1nsnc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1c(C(F)(F)F)ccc(Cl)c1F.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cc(C)nn1-c1ccccn1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C(F)F)nc1-c1cccc2cnccc12.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C)nc1-c1ccoc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cn(C2CC2)nc1-c1ccccc1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1cccc2c1OC(F)(F)O2.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1cccc(F)c1.CC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1oc(C)nc1-c1ccccc1F.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)[C@H]1CCC(=O)N1Cc1ccccc1.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1.O=CC(Cc1ccccc1)NC(=O)c1nsnc1-c1ccccc1.
What is the InChIKey of (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide?
The InChIKey is INQOJIASAHEVAC-NHMKFPFNSA-N. The full InChI is InChI=1S/C25H20F2N4O3.C25H27N3O4.C24H23N3O3.2C22H19FN2O4.C22H20N4O3S.C21H15F2N3O5S.C21H20N4O3.C20H19N3O4.C19H14ClF4NO3.C18H15N3O2S.C14H13N3O3S/c1-15(32)23(33)21(12-16-6-3-2-4-7-16)29-24(34)20-14-31(25(26)27)30-22(20)19-9-5-8-17-13-28-11-10-18(17)19;29-22-14-13-21(28(22)16-18-9-5-2-6-10-18)24(31)27-20(15-17-7-3-1-4-8-17)23(30)25(32)26-19-11-12-19;1-16(28)23(29)21(14-17-8-4-2-5-9-17)25-24(30)20-15-27(19-12-13-19)26-22(20)18-10-6-3-7-11-18;1-13(26)20(27)18(12-15-8-4-3-5-9-15)25-22(28)21-19(24-14(2)29-21)16-10-6-7-11-17(16)23;1-13(26)20(27)18(11-15-7-4-3-5-8-15)25-22(28)21-19(24-14(2)29-21)16-9-6-10-17(23)12-16;27-20(22(29)23-16-11-12-16)17(13-14-7-3-1-4-8-14)24-21(28)19-18(25-30-26-19)15-9-5-2-6-10-15;1-11(27)18(28)14(10-12-6-3-2-4-7-12)24-20(29)17-16(25-32-26-17)13-8-5-9-15-19(13)31-21(22,23)30-15;1-14-12-18(25(24-14)19-10-6-7-11-22-19)21(28)23-17(20(27)15(2)26)13-16-8-4-3-5-9-16;1-13(24)19(25)17(10-14-6-4-3-5-7-14)21-20(26)16-11-23(2)22-18(16)15-8-9-27-12-15;1-10(26)17(27)14(9-11-5-3-2-4-6-11)25-18(28)15-12(19(22,23)24)7-8-13(20)16(15)21;22-12-15(11-13-7-3-1-4-8-13)19-18(23)17-16(20-24-21-17)14-9-5-2-6-10-14;1-8(13(19)9(2)18)15-14(20)12-11(16-21-17-12)10-6-4-3-5-7-10/h2-11,13-14,21,25H,12H2,1H3,(H,29,34);1-10,19-21H,11-16H2,(H,26,32)(H,27,31);2-11,15,19,21H,12-14H2,1H3,(H,25,30);3-11,18H,12H2,1-2H3,(H,25,28);3-10,12,18H,11H2,1-2H3,(H,25,28);1-10,16-17H,11-13H2,(H,23,29)(H,24,28);2-9,14H,10H2,1H3,(H,24,29);3-12,17H,13H2,1-2H3,(H,23,28);3-9,11-12,17H,10H2,1-2H3,(H,21,26);2-8,14H,9H2,1H3,(H,25,28);1-10,12,15H,11H2,(H,19,23);3-8H,1-2H3,(H,15,20)/t;20?,21-;;;;;;;;;;/m.1........../s1.
What are the key properties of (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide?
(2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide has a molecular weight of 4764.48 g/mol, XLogP of 33.60, 85 rotatable bonds, 14 hydrogen bond donors, and 65 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-benzyl-N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-oxopyrrolidine-2-carboxamide;3-chloro-N-(3,4-dioxo-1-phenylpentan-2-yl)-2-fluoro-6-(trifluoromethyl)benzamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-phenyl-1,2,5-thiadiazole-3-carboxamide;1-cyclopropyl-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-phenylpyrazole-4-carboxamide;4-(2,2-difluoro-1,3-benzodioxol-4-yl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-1,2,5-thiadiazole-3-carboxamide;1-(difluoromethyl)-N-(3,4-dioxo-1-phenylpentan-2-yl)-3-isoquinolin-5-ylpyrazole-4-carboxamide;N-(3,4-dioxopentan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(2-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-4-(3-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-3-(furan-3-yl)-1-methylpyrazole-4-carboxamide;N-(3,4-dioxo-1-phenylpentan-2-yl)-5-methyl-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-4-phenyl-1,2,5-thiadiazole-3-carboxamide is sourced from PubChem (CID 158752443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).