6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

C14H11N3O3 — CID 135658923

IUPAC6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
SMILESCc1[nH]nc2nc(-c3ccccc3O)cc(C(=O)O)c12
InChIInChI=1S/C14H11N3O3/c1-7-12-9(14(19)20)6-10(15-13(12)17-16-7)8-4-2-3-5-11(8)18/h2-6,18H,1H3,(H,19,20)(H,15,16,17)
InChIKeyUQPKNZPRIANSRF-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.34
Rot. Bonds2

About 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid (PubChem CID 135658923) has the molecular formula C14H11N3O3 and a molecular weight of 269.26 g/mol. Its IUPAC name is 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
PubChem CID135658923
Molecular FormulaC14H11N3O3
Molecular Weight269.26 g/mol
Exact Mass269.08
IUPAC Name6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
SMILESCc1[nH]nc2nc(-c3ccccc3O)cc(C(=O)O)c12
InChIInChI=1S/C14H11N3O3/c1-7-12-9(14(19)20)6-10(15-13(12)17-16-7)8-4-2-3-5-11(8)18/h2-6,18H,1H3,(H,19,20)(H,15,16,17)
InChIKeyUQPKNZPRIANSRF-UHFFFAOYSA-N
XLogP2.34
TPSA99.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid?
The IUPAC name of 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid (CID 135658923) is 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid is Cc1[nH]nc2nc(-c3ccccc3O)cc(C(=O)O)c12.
What is the InChIKey of 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid?
The InChIKey is UQPKNZPRIANSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3/c1-7-12-9(14(19)20)6-10(15-13(12)17-16-7)8-4-2-3-5-11(8)18/h2-6,18H,1H3,(H,19,20)(H,15,16,17).
What are the key properties of 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid?
6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid has a molecular weight of 269.26 g/mol, XLogP of 2.34, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyphenyl)-3-methyl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid is sourced from PubChem (CID 135658923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).