4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol

C14H13N3O3 — CID 154667096

IUPAC4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
SMILESCOc1cc(-c2nc3ncccc3[nH]2)cc(OC)c1O
InChIInChI=1S/C14H13N3O3/c1-19-10-6-8(7-11(20-2)12(10)18)13-16-9-4-3-5-15-14(9)17-13/h3-7,18H,1-2H3,(H,15,16,17)
InChIKeyDALJOBYFMXNJDH-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.35
Rot. Bonds3

About 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol

4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol (PubChem CID 154667096) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
PubChem CID154667096
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC Name4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol
SMILESCOc1cc(-c2nc3ncccc3[nH]2)cc(OC)c1O
InChIInChI=1S/C14H13N3O3/c1-19-10-6-8(7-11(20-2)12(10)18)13-16-9-4-3-5-15-14(9)17-13/h3-7,18H,1-2H3,(H,15,16,17)
InChIKeyDALJOBYFMXNJDH-UHFFFAOYSA-N
XLogP2.35
TPSA80.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,5-dimethoxy-4-prop-2-ynoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 13121469
2-(4,6-dimethoxy-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 14369069
4-(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)-2,6-dimethoxyphenol
CID 136776464
2-(4-bromo-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 113296104
N-ethyl-N-[[5-(1H-imidazo[4,5-b]pyridin-2-yl)-2-methoxyphenyl]methyl]ethanamine
CID 59785489
4-(1H-benzimidazol-2-yl)-2-iodo-6-methoxyphenol
CID 136663190
2-[1-(2-methoxyphenyl)pyrazol-4-yl]-1H-imidazo[4,5-b]pyridine
CID 59784478
2-(3-methoxy-5-methylsulfinylthiophen-2-yl)-1H-imidazo[4,5-b]pyridine;hydrochloride
CID 23316754
3-(1H-imidazo[4,5-b]pyridin-2-yl)-5-[(2S)-1-methoxypropan-2-yl]oxyphenol;3-(1H-imidazo[4,5-b]pyridin-2-yl)-5-propan-2-yloxyphenol
CID 158074783
5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol
CID 107704555
2-(3-propan-2-yloxynaphthalen-2-yl)-1H-imidazo[4,5-b]pyridine
CID 13304825
calcium;hydride;2-methoxy-1H-imidazo[4,5-b]pyridine
CID 174521713

Frequently Asked Questions

What is the IUPAC name of 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol?
The IUPAC name of 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol (CID 154667096) is 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol.
What is the SMILES notation for 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol?
The canonical SMILES for 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol is COc1cc(-c2nc3ncccc3[nH]2)cc(OC)c1O.
What is the InChIKey of 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol?
The InChIKey is DALJOBYFMXNJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c1-19-10-6-8(7-11(20-2)12(10)18)13-16-9-4-3-5-15-14(9)17-13/h3-7,18H,1-2H3,(H,15,16,17).
What are the key properties of 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol?
4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol has a molecular weight of 271.28 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,6-dimethoxyphenol is sourced from PubChem (CID 154667096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).