2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide

C145H124ClF3N44O16 — CID 158564886

IUPAC2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
SMILESCOc1ccc(CCC(=O)Nc2n[nH]c(-c3ccccn3)n2)cc1.O=C(CCn1ccc2ccccc21)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(NC1=NN=C(c2ccccn2)C1)C1Cc2cc(Cl)ccc2O1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CCn2c(cnc2-c2ccccc2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C21H19N7O.C20H17F3N6O2.C19H14N6O2.C18H16N6O.C17H13ClN4O2.C17H15N5O3.C17H17N5O2.C16H13N5O3/c29-20(25-21-24-18(26-27-21)17-8-4-5-10-22-17)15-9-11-28-16(12-15)13-23-19(28)14-6-2-1-3-7-14;21-20(22,23)14-5-3-4-12(8-14)10-29-11-13(9-16(29)30)18(31)26-19-25-17(27-28-19)15-6-1-2-7-24-15;26-18(23-19-22-17(24-25-19)16-5-1-2-11-21-16)13-6-8-14(9-7-13)27-15-4-3-10-20-12-15;25-16(9-12-24-11-8-13-5-1-2-7-15(13)24)20-18-21-17(22-23-18)14-6-3-4-10-19-14;18-11-4-5-14-10(7-11)8-15(24-14)17(23)20-16-9-13(21-22-16)12-3-1-2-6-19-12;23-15(10-11-4-5-13-14(9-11)25-8-7-24-13)19-17-20-16(21-22-17)12-3-1-2-6-18-12;1-24-13-8-5-12(6-9-13)7-10-15(23)19-17-20-16(21-22-17)14-4-2-3-11-18-14;22-14(8-10-4-5-12-13(7-10)24-9-23-12)18-16-19-15(20-21-16)11-3-1-2-6-17-11/h1-8,10,13,15H,9,11-12H2,(H2,24,25,26,27,29);1-8,13H,9-11H2,(H2,25,26,27,28,31);1-12H,(H2,22,23,24,25,26);1-8,10-11H,9,12H2,(H2,20,21,22,23,25);1-7,15H,8-9H2,(H,20,22,23);1-6,9H,7-8,10H2,(H2,19,20,21,22,23);2-6,8-9,11H,7,10H2,1H3,(H2,19,20,21,22,23);1-7H,8-9H2,(H2,18,19,20,21,22)
InChIKeyHRIQFXWHOUMPEP-UHFFFAOYSA-N
MW2831.33 g/mol
LogP20.36
Rot. Bonds35

About 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide

2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide (PubChem CID 158564886) has the molecular formula C145H124ClF3N44O16 and a molecular weight of 2831.33 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
PubChem CID158564886
Molecular FormulaC145H124ClF3N44O16
Molecular Weight2831.33 g/mol
Exact Mass2828.99
IUPAC Name2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
SMILESCOc1ccc(CCC(=O)Nc2n[nH]c(-c3ccccn3)n2)cc1.O=C(CCn1ccc2ccccc21)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(NC1=NN=C(c2ccccn2)C1)C1Cc2cc(Cl)ccc2O1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CCn2c(cnc2-c2ccccc2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C21H19N7O.C20H17F3N6O2.C19H14N6O2.C18H16N6O.C17H13ClN4O2.C17H15N5O3.C17H17N5O2.C16H13N5O3/c29-20(25-21-24-18(26-27-21)17-8-4-5-10-22-17)15-9-11-28-16(12-15)13-23-19(28)14-6-2-1-3-7-14;21-20(22,23)14-5-3-4-12(8-14)10-29-11-13(9-16(29)30)18(31)26-19-25-17(27-28-19)15-6-1-2-7-24-15;26-18(23-19-22-17(24-25-19)16-5-1-2-11-21-16)13-6-8-14(9-7-13)27-15-4-3-10-20-12-15;25-16(9-12-24-11-8-13-5-1-2-7-15(13)24)20-18-21-17(22-23-18)14-6-3-4-10-19-14;18-11-4-5-14-10(7-11)8-15(24-14)17(23)20-16-9-13(21-22-16)12-3-1-2-6-19-12;23-15(10-11-4-5-13-14(9-11)25-8-7-24-13)19-17-20-16(21-22-17)12-3-1-2-6-18-12;1-24-13-8-5-12(6-9-13)7-10-15(23)19-17-20-16(21-22-17)14-4-2-3-11-18-14;22-14(8-10-4-5-12-13(7-10)24-9-23-12)18-16-19-15(20-21-16)11-3-1-2-6-17-11/h1-8,10,13,15H,9,11-12H2,(H2,24,25,26,27,29);1-8,13H,9-11H2,(H2,25,26,27,28,31);1-12H,(H2,22,23,24,25,26);1-8,10-11H,9,12H2,(H2,20,21,22,23,25);1-7,15H,8-9H2,(H,20,22,23);1-6,9H,7-8,10H2,(H2,19,20,21,22,23);2-6,8-9,11H,7,10H2,1H3,(H2,19,20,21,22,23);1-7H,8-9H2,(H2,18,19,20,21,22)
InChIKeyHRIQFXWHOUMPEP-UHFFFAOYSA-N
XLogP20.36
TPSA772.19 Ų
H-Bond Donors15
H-Bond Acceptors44
Rotatable Bonds35
Heavy Atoms209
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002831.33
LogP ≤ 520.36
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1044

Analyze 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?
The IUPAC name of 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide (CID 158564886) is 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?
The canonical SMILES for 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide is COc1ccc(CCC(=O)Nc2n[nH]c(-c3ccccn3)n2)cc1.O=C(CCn1ccc2ccccc21)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(Cc1ccc2c(c1)OCO2)Nc1n[nH]c(-c2ccccn2)n1.O=C(NC1=NN=C(c2ccccn2)C1)C1Cc2cc(Cl)ccc2O1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CCn2c(cnc2-c2ccccc2)C1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2cccnc2)cc1.
What is the InChIKey of 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?
The InChIKey is HRIQFXWHOUMPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N7O.C20H17F3N6O2.C19H14N6O2.C18H16N6O.C17H13ClN4O2.C17H15N5O3.C17H17N5O2.C16H13N5O3/c29-20(25-21-24-18(26-27-21)17-8-4-5-10-22-17)15-9-11-28-16(12-15)13-23-19(28)14-6-2-1-3-7-14;21-20(22,23)14-5-3-4-12(8-14)10-29-11-13(9-16(29)30)18(31)26-19-25-17(27-28-19)15-6-1-2-7-24-15;26-18(23-19-22-17(24-25-19)16-5-1-2-11-21-16)13-6-8-14(9-7-13)27-15-4-3-10-20-12-15;25-16(9-12-24-11-8-13-5-1-2-7-15(13)24)20-18-21-17(22-23-18)14-6-3-4-10-19-14;18-11-4-5-14-10(7-11)8-15(24-14)17(23)20-16-9-13(21-22-16)12-3-1-2-6-19-12;23-15(10-11-4-5-13-14(9-11)25-8-7-24-13)19-17-20-16(21-22-17)12-3-1-2-6-18-12;1-24-13-8-5-12(6-9-13)7-10-15(23)19-17-20-16(21-22-17)14-4-2-3-11-18-14;22-14(8-10-4-5-12-13(7-10)24-9-23-12)18-16-19-15(20-21-16)11-3-1-2-6-17-11/h1-8,10,13,15H,9,11-12H2,(H2,24,25,26,27,29);1-8,13H,9-11H2,(H2,25,26,27,28,31);1-12H,(H2,22,23,24,25,26);1-8,10-11H,9,12H2,(H2,20,21,22,23,25);1-7,15H,8-9H2,(H,20,22,23);1-6,9H,7-8,10H2,(H2,19,20,21,22,23);2-6,8-9,11H,7,10H2,1H3,(H2,19,20,21,22,23);1-7H,8-9H2,(H2,18,19,20,21,22).
What are the key properties of 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide?
2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide has a molecular weight of 2831.33 g/mol, XLogP of 20.36, 35 rotatable bonds, 15 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;5-chloro-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-indol-1-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;3-(4-methoxyphenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;5-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-carboxamide;3-phenyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide;4-pyridin-3-yloxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide is sourced from PubChem (CID 158564886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).