3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid

C13H9N3O3 — CID 59815650

IUPAC3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1cnc2c(c1)ncn2-c1ccc(O)cc1
InChIInChI=1S/C13H9N3O3/c17-10-3-1-9(2-4-10)16-7-15-11-5-8(13(18)19)6-14-12(11)16/h1-7,17H,(H,18,19)
InChIKeyQIIQXLQBNPGJBG-UHFFFAOYSA-N
MW255.23 g/mol
LogP1.82
Rot. Bonds2

About 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid

3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid (PubChem CID 59815650) has the molecular formula C13H9N3O3 and a molecular weight of 255.23 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid
PubChem CID59815650
Molecular FormulaC13H9N3O3
Molecular Weight255.23 g/mol
Exact Mass255.06
IUPAC Name3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1cnc2c(c1)ncn2-c1ccc(O)cc1
InChIInChI=1S/C13H9N3O3/c17-10-3-1-9(2-4-10)16-7-15-11-5-8(13(18)19)6-14-12(11)16/h1-7,17H,(H,18,19)
InChIKeyQIIQXLQBNPGJBG-UHFFFAOYSA-N
XLogP1.82
TPSA88.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid?
The IUPAC name of 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid (CID 59815650) is 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid?
The canonical SMILES for 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid is O=C(O)c1cnc2c(c1)ncn2-c1ccc(O)cc1.
What is the InChIKey of 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid?
The InChIKey is QIIQXLQBNPGJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O3/c17-10-3-1-9(2-4-10)16-7-15-11-5-8(13(18)19)6-14-12(11)16/h1-7,17H,(H,18,19).
What are the key properties of 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid?
3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid has a molecular weight of 255.23 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyphenyl)imidazo[4,5-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 59815650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).