6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine

C17H14N4S — CID 155389311

IUPAC6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine
SMILESCc1ccc(-c2cnc3cnn(Cc4cccnc4)c3c2)s1
InChIInChI=1S/C17H14N4S/c1-12-4-5-17(22-12)14-7-16-15(19-9-14)10-20-21(16)11-13-3-2-6-18-8-13/h2-10H,11H2,1H3
InChIKeyRAXABEAZBMCUAG-UHFFFAOYSA-N
MW306.39 g/mol
LogP3.91
Rot. Bonds3

About 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine

6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine (PubChem CID 155389311) has the molecular formula C17H14N4S and a molecular weight of 306.39 g/mol. Its IUPAC name is 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine
PubChem CID155389311
Molecular FormulaC17H14N4S
Molecular Weight306.39 g/mol
Exact Mass306.09
IUPAC Name6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine
SMILESCc1ccc(-c2cnc3cnn(Cc4cccnc4)c3c2)s1
InChIInChI=1S/C17H14N4S/c1-12-4-5-17(22-12)14-7-16-15(19-9-14)10-20-21(16)11-13-3-2-6-18-8-13/h2-10H,11H2,1H3
InChIKeyRAXABEAZBMCUAG-UHFFFAOYSA-N
XLogP3.91
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine with MolForge

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Related Compounds

1-[3-(4-methylpiperazin-1-yl)propyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329366
Alk-5-IN-1
CID 24880914
5-(1-methylpyrazol-4-yl)-3-pyridin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 71253921
US10377753, Example 130
CID 124175977
US10377753, Example 386
CID 124176242
11-Methyl-6-thiophen-2-ylindolizino[3,2-c]quinoline
CID 126483472
N-{[3-(2,5-dimethyl-3-thienyl)-1-(2-fluorophenyl)-1H-pyrazol-4-yl]methyl}-2-pyrazin-2-ylethanamine
CID 16190616
1-[1-(3-Methylbutyl)piperidin-4-yl]-5-(4-methylsulfonylphenyl)pyrazolo[3,4-c]pyridine
CID 127048822
3-[4-(1-Methylpyrazol-4-yl)thiophen-2-yl]pyridine
CID 145989761
N-(2-fluorophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
CID 155528043
N-(3-cyanophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]ethanethioamide
CID 155539034
N-(3-fluorophenyl)-2-[3-(6-methyl-2-pyridinyl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
CID 155541940

Frequently Asked Questions

What is the IUPAC name of 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine (CID 155389311) is 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine is Cc1ccc(-c2cnc3cnn(Cc4cccnc4)c3c2)s1.
What is the InChIKey of 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine?
The InChIKey is RAXABEAZBMCUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4S/c1-12-4-5-17(22-12)14-7-16-15(19-9-14)10-20-21(16)11-13-3-2-6-18-8-13/h2-10H,11H2,1H3.
What are the key properties of 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine?
6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine has a molecular weight of 306.39 g/mol, XLogP of 3.91, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methylthiophen-2-yl)-1-(pyridin-3-ylmethyl)pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 155389311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).