3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid

C13H10N4O2 — CID 16777618

IUPAC3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid
SMILESCc1nn(-c2ccccn2)c2ncc(C(=O)O)cc12
InChIInChI=1S/C13H10N4O2/c1-8-10-6-9(13(18)19)7-15-12(10)17(16-8)11-4-2-3-5-14-11/h2-7H,1H3,(H,18,19)
InChIKeyHRAJYOFRJQJKON-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.82
Rot. Bonds2

About 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid

3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid (PubChem CID 16777618) has the molecular formula C13H10N4O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid
PubChem CID16777618
Molecular FormulaC13H10N4O2
Molecular Weight254.25 g/mol
Exact Mass254.08
IUPAC Name3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid
SMILESCc1nn(-c2ccccn2)c2ncc(C(=O)O)cc12
InChIInChI=1S/C13H10N4O2/c1-8-10-6-9(13(18)19)7-15-12(10)17(16-8)11-4-2-3-5-14-11/h2-7H,1H3,(H,18,19)
InChIKeyHRAJYOFRJQJKON-UHFFFAOYSA-N
XLogP1.82
TPSA80.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid?
The IUPAC name of 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid (CID 16777618) is 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid.
What is the SMILES notation for 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid?
The canonical SMILES for 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid is Cc1nn(-c2ccccn2)c2ncc(C(=O)O)cc12.
What is the InChIKey of 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid?
The InChIKey is HRAJYOFRJQJKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O2/c1-8-10-6-9(13(18)19)7-15-12(10)17(16-8)11-4-2-3-5-14-11/h2-7H,1H3,(H,18,19).
What are the key properties of 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid?
3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid has a molecular weight of 254.25 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridine-5-carboxylic acid is sourced from PubChem (CID 16777618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).