N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide

C24H24N4O2 — CID 9244561

IUPACN-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cc(C)nc2c1cnn2Cc1ccc(C)cc1
InChIInChI=1S/C24H24N4O2/c1-15-5-8-18(9-6-15)14-28-23-20(13-25-28)19(12-17(3)26-23)24(29)27-21-11-16(2)7-10-22(21)30-4/h5-13H,14H2,1-4H3,(H,27,29)
InChIKeyZNHJFUFPMXHGBT-UHFFFAOYSA-N
MW400.48 g/mol
LogP4.67
Rot. Bonds5

About N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide

N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide (PubChem CID 9244561) has the molecular formula C24H24N4O2 and a molecular weight of 400.48 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide
PubChem CID9244561
Molecular FormulaC24H24N4O2
Molecular Weight400.48 g/mol
Exact Mass400.19
IUPAC NameN-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cc(C)nc2c1cnn2Cc1ccc(C)cc1
InChIInChI=1S/C24H24N4O2/c1-15-5-8-18(9-6-15)14-28-23-20(13-25-28)19(12-17(3)26-23)24(29)27-21-11-16(2)7-10-22(21)30-4/h5-13H,14H2,1-4H3,(H,27,29)
InChIKeyZNHJFUFPMXHGBT-UHFFFAOYSA-N
XLogP4.67
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide
CID 46636846
N-[2-methoxy-5-(methylcarbamoyl)phenyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 78887349
N,6-dimethyl-1-[(4-methylphenyl)methyl]-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide
CID 46636760
1-ethyl-6-methyl-N-(1H-pyrazol-5-yl)pyrazolo[3,4-b]pyridine-4-carboxamide
CID 167808770
N-(2-methoxy-5-methylphenyl)-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109256299
N-(2-methoxy-5-methylphenyl)-1-[(4-methylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697109
4-N,5-N-bis(2-methoxy-5-methylphenyl)-1-methylpyrazole-4,5-dicarboxamide
CID 29096938
N-(2-methoxy-5-methylphenyl)-3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 20927945
[6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridin-4-yl]-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methanone
CID 17480576
1-benzyl-N-(2-methylsulfonylphenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55535001
1-benzyl-6-(4-methylphenyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 113220360
N-(2-methoxy-5-methylphenyl)isoquinoline-8-carboxamide
CID 110860308

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide (CID 9244561) is N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide is COc1ccc(C)cc1NC(=O)c1cc(C)nc2c1cnn2Cc1ccc(C)cc1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide?
The InChIKey is ZNHJFUFPMXHGBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2/c1-15-5-8-18(9-6-15)14-28-23-20(13-25-28)19(12-17(3)26-23)24(29)27-21-11-16(2)7-10-22(21)30-4/h5-13H,14H2,1-4H3,(H,27,29).
What are the key properties of N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide?
N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide has a molecular weight of 400.48 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-6-methyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9244561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).