4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol

C13H9BrN2O — CID 62706602

IUPAC4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol
SMILESOc1ccc(Br)cc1-c1cn2ccccc2n1
InChIInChI=1S/C13H9BrN2O/c14-9-4-5-12(17)10(7-9)11-8-16-6-2-1-3-13(16)15-11/h1-8,17H
InChIKeyYVPJXMKJGRMJGR-UHFFFAOYSA-N
MW289.13 g/mol
LogP3.47
Rot. Bonds1

About 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol

4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol (PubChem CID 62706602) has the molecular formula C13H9BrN2O and a molecular weight of 289.13 g/mol. Its IUPAC name is 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol.

Molecular Properties

Compound Name4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol
PubChem CID62706602
Molecular FormulaC13H9BrN2O
Molecular Weight289.13 g/mol
Exact Mass287.99
IUPAC Name4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol
SMILESOc1ccc(Br)cc1-c1cn2ccccc2n1
InChIInChI=1S/C13H9BrN2O/c14-9-4-5-12(17)10(7-9)11-8-16-6-2-1-3-13(16)15-11/h1-8,17H
InChIKeyYVPJXMKJGRMJGR-UHFFFAOYSA-N
XLogP3.47
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.13
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol?
The IUPAC name of 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol (CID 62706602) is 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol.
What is the SMILES notation for 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol?
The canonical SMILES for 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol is Oc1ccc(Br)cc1-c1cn2ccccc2n1.
What is the InChIKey of 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol?
The InChIKey is YVPJXMKJGRMJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrN2O/c14-9-4-5-12(17)10(7-9)11-8-16-6-2-1-3-13(16)15-11/h1-8,17H.
What are the key properties of 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol?
4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol has a molecular weight of 289.13 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-imidazo[1,2-a]pyridin-2-ylphenol is sourced from PubChem (CID 62706602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).