1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide

C23H22N4O4 — CID 44822498

IUPAC1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C)cc(OC)c1OC
InChIInChI=1S/C23H22N4O4/c1-27-22-17(13-24-27)16(12-18(26-22)14-8-6-5-7-9-14)23(28)25-15-10-19(29-2)21(31-4)20(11-15)30-3/h5-13H,1-4H3,(H,25,28)
InChIKeyCNTWZYNPFINOFD-UHFFFAOYSA-N
MW418.45 g/mol
LogP3.91
Rot. Bonds6

About 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide

1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 44822498) has the molecular formula C23H22N4O4 and a molecular weight of 418.45 g/mol. Its IUPAC name is 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID44822498
Molecular FormulaC23H22N4O4
Molecular Weight418.45 g/mol
Exact Mass418.16
IUPAC Name1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1cc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C)cc(OC)c1OC
InChIInChI=1S/C23H22N4O4/c1-27-22-17(13-24-27)16(12-18(26-22)14-8-6-5-7-9-14)23(28)25-15-10-19(29-2)21(31-4)20(11-15)30-3/h5-13H,1-4H3,(H,25,28)
InChIKeyCNTWZYNPFINOFD-UHFFFAOYSA-N
XLogP3.91
TPSA87.50 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-chlorophenyl)-6-(4-methoxyphenyl)-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134800795
N-(2-ethoxyphenyl)-1-methyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 44822777
N-(4-fluorophenyl)-6-(2-methoxyphenyl)-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134803264
N-(3-fluorophenyl)-6-(3-methoxyphenyl)-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134802909
6-(4-methoxyphenyl)-1-methyl-N-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 134801357
6-(3-fluorophenyl)-N-(4-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134802464
2-(3,4-dimethoxyphenyl)-N-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 2161835
1-methyl-6-phenyl-N-(thiophen-2-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 134791791
7-(difluoromethyl)-5-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 995519
1-ethyl-6-thiophen-2-yl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 18273145
N-(2-fluorophenyl)-1-methyl-6-[4-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 134801712
N-(2-fluorophenyl)-1-methyl-6-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
CID 134800727

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 44822498) is 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide is COc1cc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C)cc(OC)c1OC.
What is the InChIKey of 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is CNTWZYNPFINOFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O4/c1-27-22-17(13-24-27)16(12-18(26-22)14-8-6-5-7-9-14)23(28)25-15-10-19(29-2)21(31-4)20(11-15)30-3/h5-13H,1-4H3,(H,25,28).
What are the key properties of 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 418.45 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-phenyl-N-(3,4,5-trimethoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 44822498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).