N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

C100H90F6N16O6 — CID 158510837

IUPACN-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)cc1.COc1cccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)c1.Cc1cc(-c2ccc(NC(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)cc2)c2cnn(C)c2n1.Cc1cc(-c2ccc(NC(=O)C3(c4cccc(C(F)(F)F)c4)CC3)cc2)c2cnn(C)c2n1
InChIInChI=1S/2C25H21F3N4O.2C25H24N4O2/c1-15-13-20(21-14-29-32(2)22(21)30-15)16-3-9-19(10-4-16)31-23(33)24(11-12-24)17-5-7-18(8-6-17)25(26,27)28;1-15-12-20(21-14-29-32(2)22(21)30-15)16-6-8-19(9-7-16)31-23(33)24(10-11-24)17-4-3-5-18(13-17)25(26,27)28;1-16-14-21(22-15-26-29(2)23(22)27-16)17-4-8-19(9-5-17)28-24(30)25(12-13-25)18-6-10-20(31-3)11-7-18;1-16-13-21(22-15-26-29(2)23(22)27-16)17-7-9-19(10-8-17)28-24(30)25(11-12-25)18-5-4-6-20(14-18)31-3/h3-10,13-14H,11-12H2,1-2H3,(H,31,33);3-9,12-14H,10-11H2,1-2H3,(H,31,33);4-11,14-15H,12-13H2,1-3H3,(H,28,30);4-10,13-15H,11-12H2,1-3H3,(H,28,30)
InChIKeyHLAKTNKMPDXWBU-UHFFFAOYSA-N
MW1725.91 g/mol
LogP20.51
Rot. Bonds18

About N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide

N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (PubChem CID 158510837) has the molecular formula C100H90F6N16O6 and a molecular weight of 1725.91 g/mol. Its IUPAC name is N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
PubChem CID158510837
Molecular FormulaC100H90F6N16O6
Molecular Weight1725.91 g/mol
Exact Mass1724.71
IUPAC NameN-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)cc1.COc1cccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)c1.Cc1cc(-c2ccc(NC(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)cc2)c2cnn(C)c2n1.Cc1cc(-c2ccc(NC(=O)C3(c4cccc(C(F)(F)F)c4)CC3)cc2)c2cnn(C)c2n1
InChIInChI=1S/2C25H21F3N4O.2C25H24N4O2/c1-15-13-20(21-14-29-32(2)22(21)30-15)16-3-9-19(10-4-16)31-23(33)24(11-12-24)17-5-7-18(8-6-17)25(26,27)28;1-15-12-20(21-14-29-32(2)22(21)30-15)16-6-8-19(9-7-16)31-23(33)24(10-11-24)17-4-3-5-18(13-17)25(26,27)28;1-16-14-21(22-15-26-29(2)23(22)27-16)17-4-8-19(9-5-17)28-24(30)25(12-13-25)18-6-10-20(31-3)11-7-18;1-16-13-21(22-15-26-29(2)23(22)27-16)17-7-9-19(10-8-17)28-24(30)25(11-12-25)18-5-4-6-20(14-18)31-3/h3-10,13-14H,11-12H2,1-2H3,(H,31,33);3-9,12-14H,10-11H2,1-2H3,(H,31,33);4-11,14-15H,12-13H2,1-3H3,(H,28,30);4-10,13-15H,11-12H2,1-3H3,(H,28,30)
InChIKeyHLAKTNKMPDXWBU-UHFFFAOYSA-N
XLogP20.51
TPSA257.70 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds18
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001725.91
LogP ≤ 520.51
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Analyze N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide with MolForge

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Related Compounds

N-(3,5-difluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157068880
3-[4-[4-amino-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-(2-fluoro-3-pyridinyl)propan-1-one;3-[4-[4-amino-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-(2-methylphenyl)propan-1-one;3-[4-[4-amino-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-[3-(trifluoromethoxy)phenyl]propan-1-one;3-[4-[4-amino-1-[(3R)-1-prop-2-enoylpiperidin-3-yl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-[4-(trifluoromethoxy)phenyl]propan-1-one
CID 157073829
3-[4-[4-Amino-1-(1-prop-2-enoylpiperidin-3-yl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-(2-fluoro-3-pyridinyl)propan-1-one;3-[4-[4-amino-1-(1-prop-2-enoylpiperidin-3-yl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-(2-methylphenyl)propan-1-one;3-[4-[4-amino-1-(1-prop-2-enoylpiperidin-3-yl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-[3-(trifluoromethoxy)phenyl]propan-1-one;3-[4-[4-amino-1-(1-prop-2-enoylpiperidin-3-yl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-1-[4-(trifluoromethoxy)phenyl]propan-1-one
CID 157073834
N-[4-(6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-2-methyl-2-phenylpropanamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-phenylcyclopropane-1-carboxamide;1-(3-methoxyphenyl)-N-[4-(6-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]cyclopropane-1-carboxamide;N-[4-(6-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 157285032
N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(2-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-phenyl-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157307599
N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(3-amino-6-tert-butyl-1-methylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(3-amino-1-methyl-6-propan-2-ylpyrazolo[5,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 157966402
4-[[8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-morpholin-4-ylethyl)benzamide;4-[[8-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-morpholin-4-ylethyl)benzamide;N-methyl-4-[[8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 157975420
(3E)-3-[[7-(cyclopropylamino)-5-[(3,5-difluorophenyl)methyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]pyrrolidine-2,5-dione;(3E)-3-[[7-(cyclopropylamino)-5-[(3-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]pyrrolidine-2,5-dione;(3E)-3-[[7-(cyclopropylamino)-5-[(3-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]pyrrolidine-2,5-dione;(3E)-3-[[7-(cyclopropylamino)-5-[(3-methylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]pyrrolidine-2,5-dione;(3E)-3-[[7-(cyclopropylamino)-5-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidin-3-yl]methylidene]pyrrolidine-2,5-dione
CID 158200963
2-[3-(1,1-difluoroethyl)phenyl]-1-[4-(6-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone;2-(3-ethoxyphenyl)-1-[4-(6-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone;3-(4-methylphenyl)-1-[4-(6-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one;3-(4-methylphenyl)-1-[4-(6-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]propan-1-one
CID 158454169
5-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-[[4-(3-pyrrolidin-1-ylpropyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2-[[4-(3-pyrrolidin-1-ylpropyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyridine;N-[4-[[5-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methyl]phenyl]-N-methyl-2-morpholin-4-ylpropanamide;2-[[4-(3-pyrrolidin-1-ylpropyl)phenyl]methyl]-5-[1-[[3-(trifluoromethoxy)phenyl]methyl]pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 158575134
4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(1-methylpiperidin-4-yl)benzamide;4-[[8-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-piperidin-4-ylbenzamide;4-[[8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-morpholin-4-ylethyl)benzamide;N-methyl-4-[[8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
CID 159004653
N,N-dimethyl-4-[[8-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N-(3-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(2-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methylphenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-phenyl-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 159157298

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?
The IUPAC name of N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide (CID 158510837) is N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is COc1ccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)cc1.COc1cccc(C2(C(=O)Nc3ccc(-c4cc(C)nc5c4cnn5C)cc3)CC2)c1.Cc1cc(-c2ccc(NC(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)cc2)c2cnn(C)c2n1.Cc1cc(-c2ccc(NC(=O)C3(c4cccc(C(F)(F)F)c4)CC3)cc2)c2cnn(C)c2n1.
What is the InChIKey of N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?
The InChIKey is HLAKTNKMPDXWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H21F3N4O.2C25H24N4O2/c1-15-13-20(21-14-29-32(2)22(21)30-15)16-3-9-19(10-4-16)31-23(33)24(11-12-24)17-5-7-18(8-6-17)25(26,27)28;1-15-12-20(21-14-29-32(2)22(21)30-15)16-6-8-19(9-7-16)31-23(33)24(10-11-24)17-4-3-5-18(13-17)25(26,27)28;1-16-14-21(22-15-26-29(2)23(22)27-16)17-4-8-19(9-5-17)28-24(30)25(12-13-25)18-6-10-20(31-3)11-7-18;1-16-13-21(22-15-26-29(2)23(22)27-16)17-7-9-19(10-8-17)28-24(30)25(11-12-25)18-5-4-6-20(14-18)31-3/h3-10,13-14H,11-12H2,1-2H3,(H,31,33);3-9,12-14H,10-11H2,1-2H3,(H,31,33);4-11,14-15H,12-13H2,1-3H3,(H,28,30);4-10,13-15H,11-12H2,1-3H3,(H,28,30).
What are the key properties of N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide?
N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide has a molecular weight of 1725.91 g/mol, XLogP of 20.51, 18 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(3-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-(4-methoxyphenyl)cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide;N-[4-(1,6-dimethylpyrazolo[3,4-b]pyridin-4-yl)phenyl]-1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 158510837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).