6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine

C16H15BrN2O — CID 115403609

IUPAC6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine
SMILESCCOc1ccc(-c2cn3c(C)c(Br)ccc3n2)cc1
InChIInChI=1S/C16H15BrN2O/c1-3-20-13-6-4-12(5-7-13)15-10-19-11(2)14(17)8-9-16(19)18-15/h4-10H,3H2,1-2H3
InChIKeyVFTSZEIDSBLMCH-UHFFFAOYSA-N
MW331.21 g/mol
LogP4.47
Rot. Bonds3

About 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine

6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine (PubChem CID 115403609) has the molecular formula C16H15BrN2O and a molecular weight of 331.21 g/mol. Its IUPAC name is 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine
PubChem CID115403609
Molecular FormulaC16H15BrN2O
Molecular Weight331.21 g/mol
Exact Mass330.04
IUPAC Name6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine
SMILESCCOc1ccc(-c2cn3c(C)c(Br)ccc3n2)cc1
InChIInChI=1S/C16H15BrN2O/c1-3-20-13-6-4-12(5-7-13)15-10-19-11(2)14(17)8-9-16(19)18-15/h4-10H,3H2,1-2H3
InChIKeyVFTSZEIDSBLMCH-UHFFFAOYSA-N
XLogP4.47
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.21
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine (CID 115403609) is 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine is CCOc1ccc(-c2cn3c(C)c(Br)ccc3n2)cc1.
What is the InChIKey of 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine?
The InChIKey is VFTSZEIDSBLMCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrN2O/c1-3-20-13-6-4-12(5-7-13)15-10-19-11(2)14(17)8-9-16(19)18-15/h4-10H,3H2,1-2H3.
What are the key properties of 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine?
6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine has a molecular weight of 331.21 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 115403609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).