5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol

C13H11N3O3 — CID 107704555

IUPAC5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol
SMILESCOc1ccc2[nH]c(-c3cc(O)cc(O)c3)nc2n1
InChIInChI=1S/C13H11N3O3/c1-19-11-3-2-10-13(15-11)16-12(14-10)7-4-8(17)6-9(18)5-7/h2-6,17-18H,1H3,(H,14,15,16)
InChIKeyHMTNECYFDYSFHV-UHFFFAOYSA-N
MW257.25 g/mol
LogP2.04
Rot. Bonds2

About 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol

5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol (PubChem CID 107704555) has the molecular formula C13H11N3O3 and a molecular weight of 257.25 g/mol. Its IUPAC name is 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol.

Molecular Properties

Compound Name5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol
PubChem CID107704555
Molecular FormulaC13H11N3O3
Molecular Weight257.25 g/mol
Exact Mass257.08
IUPAC Name5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol
SMILESCOc1ccc2[nH]c(-c3cc(O)cc(O)c3)nc2n1
InChIInChI=1S/C13H11N3O3/c1-19-11-3-2-10-13(15-11)16-12(14-10)7-4-8(17)6-9(18)5-7/h2-6,17-18H,1H3,(H,14,15,16)
InChIKeyHMTNECYFDYSFHV-UHFFFAOYSA-N
XLogP2.04
TPSA91.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,4-diol
CID 136903811
2-(3-bromo-5-methylphenyl)-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 115999492
4-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-3-methylphenol
CID 136750901
5-(5-amino-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol
CID 107704580
6-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)quinoxaline
CID 65483661
4-[4-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]benzoic acid
CID 167974159
2-fluoro-5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 65485203
2-(3-chloro-4-fluorophenyl)-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 82879286
5-methoxy-2-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridine
CID 65485621
2-[3-(difluoromethoxy)phenyl]-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 65483074
2-(2,5-dichlorophenyl)-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 65482699
2-(3-chloronaphthalen-2-yl)-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 70461397

Frequently Asked Questions

What is the IUPAC name of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol?
The IUPAC name of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol (CID 107704555) is 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol.
What is the SMILES notation for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol?
The canonical SMILES for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol is COc1ccc2[nH]c(-c3cc(O)cc(O)c3)nc2n1.
What is the InChIKey of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol?
The InChIKey is HMTNECYFDYSFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O3/c1-19-11-3-2-10-13(15-11)16-12(14-10)7-4-8(17)6-9(18)5-7/h2-6,17-18H,1H3,(H,14,15,16).
What are the key properties of 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol?
5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol has a molecular weight of 257.25 g/mol, XLogP of 2.04, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzene-1,3-diol is sourced from PubChem (CID 107704555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).