2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid

C14H11N3O3 — CID 19821938

IUPAC2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid
SMILESO=C(O)COc1cccc(-c2nc3ncccc3[nH]2)c1
InChIInChI=1S/C14H11N3O3/c18-12(19)8-20-10-4-1-3-9(7-10)13-16-11-5-2-6-15-14(11)17-13/h1-7H,8H2,(H,18,19)(H,15,16,17)
InChIKeySKFPPXAUYHNFNE-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.09
Rot. Bonds4

About 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid

2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid (PubChem CID 19821938) has the molecular formula C14H11N3O3 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid.

Molecular Properties

Compound Name2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid
PubChem CID19821938
Molecular FormulaC14H11N3O3
Molecular Weight269.26 g/mol
Exact Mass269.08
IUPAC Name2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid
SMILESO=C(O)COc1cccc(-c2nc3ncccc3[nH]2)c1
InChIInChI=1S/C14H11N3O3/c18-12(19)8-20-10-4-1-3-9(7-10)13-16-11-5-2-6-15-14(11)17-13/h1-7H,8H2,(H,18,19)(H,15,16,17)
InChIKeySKFPPXAUYHNFNE-UHFFFAOYSA-N
XLogP2.09
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-3-methoxypropanamide
CID 91012537
2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethanamine
CID 63794425
2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821325
2-(3-pyridin-3-yl-1H-pyrazol-5-yl)-1H-imidazo[4,5-b]pyridine
CID 137042112
4-(1H-imidazo[4,5-b]pyridin-2-yl)benzohydrazide
CID 138857529
2-[3-(2-phenylethoxy)-5-phenylmethoxyphenyl]-1H-imidazo[4,5-b]pyridine
CID 59243231
2-[3-(naphthalen-1-ylmethoxy)-5-phenylmethoxyphenyl]-1H-imidazo[4,5-b]pyridine;2,2,2-trifluoroacetic acid
CID 66775296
2-[3-(1H-imidazol-5-yl)phenoxy]acetic acid
CID 69090482
3-[3-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenyl]phenoxy]-2-oxopropanoic acid
CID 59107126
4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
CID 154667096
2-[3-[(4-methylsulfonylphenyl)methoxy]-5-phenoxyphenyl]-1H-imidazo[4,5-b]pyridine
CID 59243010
6-bromo-2-(3-ethoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 23026040

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid?
The IUPAC name of 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid (CID 19821938) is 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid.
What is the SMILES notation for 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid?
The canonical SMILES for 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid is O=C(O)COc1cccc(-c2nc3ncccc3[nH]2)c1.
What is the InChIKey of 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid?
The InChIKey is SKFPPXAUYHNFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3/c18-12(19)8-20-10-4-1-3-9(7-10)13-16-11-5-2-6-15-14(11)17-13/h1-7H,8H2,(H,18,19)(H,15,16,17).
What are the key properties of 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid?
2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid has a molecular weight of 269.26 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1H-imidazo[4,5-b]pyridin-2-yl)phenoxy]acetic acid is sourced from PubChem (CID 19821938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).