N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide

C106H100N26O10S — CID 157325253

IUPACN-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCC(=O)NCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CCC(COC)NC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CSCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCC1CCCO1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccccn1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccco1)c1cnc2n[nH]c(-c3ccccc3)c2c1
InChIInChI=1S/C19H15N5O.C18H18N4O2.C18H14N4O2.C18H20N4O2.C17H17N5O2.C16H16N4OS/c25-19(22-12-15-8-4-5-9-20-15)14-10-16-17(13-6-2-1-3-7-13)23-24-18(16)21-11-14;2*23-18(20-11-14-7-4-8-24-14)13-9-15-16(12-5-2-1-3-6-12)21-22-17(15)19-10-13;1-3-14(11-24-2)20-18(23)13-9-15-16(12-7-5-4-6-8-12)21-22-17(15)19-10-13;1-11(23)18-7-8-19-17(24)13-9-14-15(12-5-3-2-4-6-12)21-22-16(14)20-10-13;1-22-8-7-17-16(21)12-9-13-14(11-5-3-2-4-6-11)19-20-15(13)18-10-12/h1-11H,12H2,(H,22,25)(H,21,23,24);1-3,5-6,9-10,14H,4,7-8,11H2,(H,20,23)(H,19,21,22);1-10H,11H2,(H,20,23)(H,19,21,22);4-10,14H,3,11H2,1-2H3,(H,20,23)(H,19,21,22);2-6,9-10H,7-8H2,1H3,(H,18,23)(H,19,24)(H,20,21,22);2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,19,20)
InChIKeyBEQJAAXZFKAIMI-UHFFFAOYSA-N
MW1930.20 g/mol
LogP15.62
Rot. Bonds28

About N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide

N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 157325253) has the molecular formula C106H100N26O10S and a molecular weight of 1930.20 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID157325253
Molecular FormulaC106H100N26O10S
Molecular Weight1930.20 g/mol
Exact Mass1928.78
IUPAC NameN-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCC(=O)NCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CCC(COC)NC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CSCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCC1CCCO1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccccn1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccco1)c1cnc2n[nH]c(-c3ccccc3)c2c1
InChIInChI=1S/C19H15N5O.C18H18N4O2.C18H14N4O2.C18H20N4O2.C17H17N5O2.C16H16N4OS/c25-19(22-12-15-8-4-5-9-20-15)14-10-16-17(13-6-2-1-3-7-13)23-24-18(16)21-11-14;2*23-18(20-11-14-7-4-8-24-14)13-9-15-16(12-5-2-1-3-6-12)21-22-17(15)19-10-13;1-3-14(11-24-2)20-18(23)13-9-15-16(12-7-5-4-6-8-12)21-22-17(15)19-10-13;1-11(23)18-7-8-19-17(24)13-9-14-15(12-5-3-2-4-6-12)21-22-16(14)20-10-13;1-22-8-7-17-16(21)12-9-13-14(11-5-3-2-4-6-11)19-20-15(13)18-10-12/h1-11H,12H2,(H,22,25)(H,21,23,24);1-3,5-6,9-10,14H,4,7-8,11H2,(H,20,23)(H,19,21,22);1-10H,11H2,(H,20,23)(H,19,21,22);4-10,14H,3,11H2,1-2H3,(H,20,23)(H,19,21,22);2-6,9-10H,7-8H2,1H3,(H,18,23)(H,19,24)(H,20,21,22);2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,19,20)
InChIKeyBEQJAAXZFKAIMI-UHFFFAOYSA-N
XLogP15.62
TPSA497.61 Ų
H-Bond Donors13
H-Bond Acceptors24
Rotatable Bonds28
Heavy Atoms143
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001930.20
LogP ≤ 515.62
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide with MolForge

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Related Compounds

6-amino-N-[3-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-[(3,5-dimethylfuran-2-carbonyl)amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;5-methyl-N-[3-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]propyl]pyridine-3-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;4-phenyl-N-[3-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]propyl]pyridine-2-carboxamide;N-[3-(3H-pyrazole-4-carbonylamino)propyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide;N-[3-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]propyl]-[1,2,4]triazolo[1,5-a]pyridine-2-carboxamide;N-[3-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 159840038
2-[3-[(3R)-3-(dimethylamino)pyrrolidine-1-carbonyl]phenyl]-1-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethanone;N-(furan-2-ylmethyl)-N-methyl-3-[2-oxo-2-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethyl]benzamide;N-(2-hydroxyethyl)-N-methyl-3-[2-oxo-2-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethyl]benzamide;N-(4-methylcyclohexyl)-3-[2-oxo-2-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethyl]benzamide;3-[2-oxo-2-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethyl]-N-(3-piperidin-1-ylpropyl)benzamide;3-[2-oxo-2-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide;2-[3-(piperidine-1-carbonyl)phenyl]-1-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)ethanone
CID 160444620
CID 160965532
CID 160965532
(5Z)-5-[[2-[[4-[[2-(1-benzofuran-2-yl)-3-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[[2-(1H-pyrazol-5-yl)-3-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[[2-(1H-pyrrol-2-yl)-3-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[[2-[4-(trifluoromethyl)phenyl]-3-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione
CID 161500531
4-[3-[[5-(aminomethyl)-2-pyridinyl]oxy]propylamino]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;N-[3-(difluoromethyl)-1-[4-[[[6-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]propoxy]-3-pyridinyl]methylamino]methyl]cyclohexyl]pyrazol-4-yl]-5-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-(difluoromethyl)-1-[4-[[[6-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]propoxy]-3-pyridinyl]methyl-methylamino]methyl]cyclohexyl]pyrazol-4-yl]-5-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[3-(difluoromethyl)-1-(4-formylcyclohexyl)pyrazol-4-yl]-5-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide;2,2,2-trifluoroacetaldehyde
CID 161696927
[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[2-(difluoromethyl)-5-methylpyrazol-3-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(2-ethyl-5-methylpyrazol-3-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(5-ethylthiophen-2-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[5-(furan-2-yl)-1H-pyrazol-3-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[2-(2,2,2-trifluoroethyl)pyrazol-3-yl]methanone;(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 162287374
[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[5-(1,1-difluoroethyl)-1-methylpyrazol-3-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[4-(furan-2-yl)-1-methylpyrazol-5-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyrimidin-2-ylmethanone
CID 162287395
[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[2-(difluoromethyl)-5-methylpyrazol-3-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(5-ethylthiophen-2-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[5-(furan-2-yl)-1H-pyrazol-3-yl]methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[2-(2,2,2-trifluoroethyl)pyrazol-3-yl]methanone;(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 162287490
3-[4-(1,1-difluoroethoxy)phenyl]-1-[5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-2-pyridinyl]propan-1-one;N-[(1R)-1-(4-ethoxyphenyl)ethyl]-3-methyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrimidin-2-yl]pyridine-2-carboxamide;N-[(1S)-1-(4-ethoxyphenyl)ethyl]-3-methyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrimidin-2-yl]pyridine-2-carboxamide;3-methyl-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrimidin-2-yl]-N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrimidin-2-yl]-N-[[5-(4-methylpyrazol-1-yl)pyrazin-2-yl]methyl]pyridine-2-carboxamide;5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)methyl]pyrimidin-2-yl]-N-[[6-(4-methylpyrazol-1-yl)-3-pyridinyl]methyl]pyridine-2-carboxamide
CID 164985706
[3-[8-Amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-6-yl]phenyl]-(4-benzylpiperazin-1-yl)methanone;[3-[8-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-6-yl]phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 87838159
N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-7-[4-[2-[5-(4-methyl-3-pyridinyl)-1H-pyrazolo[5,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]furan-3-yl]-1H-pyrazolo[5,4-b]pyridin-7-ium-5-yl]-3-pyridinyl]-3-methylbutanamide
CID 137147166
8-amino-N-ethyl-N-(2-methoxyethyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[8-amino-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-thiomorpholin-4-ylmethanone;8-amino-N-methyl-2-(5-methylfuran-2-yl)-N-propyl-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[4-amino-2-(5-methylthiophen-2-yl)pyrazolo[1,5-a]pyridin-6-yl]-pyrrolidin-1-ylmethanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(2-methylpyrrolidin-1-yl)methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-piperidin-1-ylmethanone
CID 157068617

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide (CID 157325253) is N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide is CC(=O)NCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CCC(COC)NC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.CSCCNC(=O)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCC1CCCO1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccccn1)c1cnc2n[nH]c(-c3ccccc3)c2c1.O=C(NCc1ccco1)c1cnc2n[nH]c(-c3ccccc3)c2c1.
What is the InChIKey of N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is BEQJAAXZFKAIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O.C18H18N4O2.C18H14N4O2.C18H20N4O2.C17H17N5O2.C16H16N4OS/c25-19(22-12-15-8-4-5-9-20-15)14-10-16-17(13-6-2-1-3-7-13)23-24-18(16)21-11-14;2*23-18(20-11-14-7-4-8-24-14)13-9-15-16(12-5-2-1-3-6-12)21-22-17(15)19-10-13;1-3-14(11-24-2)20-18(23)13-9-15-16(12-7-5-4-6-8-12)21-22-17(15)19-10-13;1-11(23)18-7-8-19-17(24)13-9-14-15(12-5-3-2-4-6-12)21-22-16(14)20-10-13;1-22-8-7-17-16(21)12-9-13-14(11-5-3-2-4-6-11)19-20-15(13)18-10-12/h1-11H,12H2,(H,22,25)(H,21,23,24);1-3,5-6,9-10,14H,4,7-8,11H2,(H,20,23)(H,19,21,22);1-10H,11H2,(H,20,23)(H,19,21,22);4-10,14H,3,11H2,1-2H3,(H,20,23)(H,19,21,22);2-6,9-10H,7-8H2,1H3,(H,18,23)(H,19,24)(H,20,21,22);2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,19,20).
What are the key properties of N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide?
N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 1930.20 g/mol, XLogP of 15.62, 28 rotatable bonds, 13 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(furan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(1-methoxybutan-2-yl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(2-methylsulfanylethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;N-(oxolan-2-ylmethyl)-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxamide;3-phenyl-N-(pyridin-2-ylmethyl)-2H-pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 157325253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).