5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine

C13H11FN4O — CID 104786102

IUPAC5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3cncc(F)c3)nc2n1
InChIInChI=1S/C13H11FN4O/c1-2-19-11-4-3-10-13(17-11)18-12(16-10)8-5-9(14)7-15-6-8/h3-7H,2H2,1H3,(H,16,17,18)
InChIKeyPWWAFIPGUVQCEK-UHFFFAOYSA-N
MW258.26 g/mol
LogP2.56
Rot. Bonds3

About 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine

5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 104786102) has the molecular formula C13H11FN4O and a molecular weight of 258.26 g/mol. Its IUPAC name is 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
PubChem CID104786102
Molecular FormulaC13H11FN4O
Molecular Weight258.26 g/mol
Exact Mass258.09
IUPAC Name5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
SMILESCCOc1ccc2[nH]c(-c3cncc(F)c3)nc2n1
InChIInChI=1S/C13H11FN4O/c1-2-19-11-4-3-10-13(17-11)18-12(16-10)8-5-9(14)7-15-6-8/h3-7H,2H2,1H3,(H,16,17,18)
InChIKeyPWWAFIPGUVQCEK-UHFFFAOYSA-N
XLogP2.56
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.26
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-difluorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
CID 79815768
5-ethoxy-2-(6-methyl-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 79815692
4-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
CID 79816479
2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine
CID 104786090
5-ethoxy-2-(2,4,6-trimethylphenyl)-1H-imidazo[4,5-b]pyridine
CID 79816768
3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)benzonitrile
CID 79815989
2-(2,4-dimethylphenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
CID 79815456
2-(5-bromo-2-pyridinyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
CID 79816067
2-(2,5-dichlorophenyl)-5-ethoxy-1H-imidazo[4,5-b]pyridine
CID 79816142
5-ethoxy-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79815994
4-bromo-3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 115296290
5-bromo-2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 79816047

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine (CID 104786102) is 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine is CCOc1ccc2[nH]c(-c3cncc(F)c3)nc2n1.
What is the InChIKey of 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is PWWAFIPGUVQCEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4O/c1-2-19-11-4-3-10-13(17-11)18-12(16-10)8-5-9(14)7-15-6-8/h3-7H,2H2,1H3,(H,16,17,18).
What are the key properties of 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine?
5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 258.26 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-2-(5-fluoro-3-pyridinyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 104786102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).