6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine

C14H11BrN2O — CID 117256189

IUPAC6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine
SMILESBrc1ccc2ncc(COc3ccccc3)n2c1
InChIInChI=1S/C14H11BrN2O/c15-11-6-7-14-16-8-12(17(14)9-11)10-18-13-4-2-1-3-5-13/h1-9H,10H2
InChIKeyJZMOHAITYZNLKY-UHFFFAOYSA-N
MW303.16 g/mol
LogP3.68
Rot. Bonds3

About 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine

6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine (PubChem CID 117256189) has the molecular formula C14H11BrN2O and a molecular weight of 303.16 g/mol. Its IUPAC name is 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine
PubChem CID117256189
Molecular FormulaC14H11BrN2O
Molecular Weight303.16 g/mol
Exact Mass302.01
IUPAC Name6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine
SMILESBrc1ccc2ncc(COc3ccccc3)n2c1
InChIInChI=1S/C14H11BrN2O/c15-11-6-7-14-16-8-12(17(14)9-11)10-18-13-4-2-1-3-5-13/h1-9H,10H2
InChIKeyJZMOHAITYZNLKY-UHFFFAOYSA-N
XLogP3.68
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine (CID 117256189) is 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine is Brc1ccc2ncc(COc3ccccc3)n2c1.
What is the InChIKey of 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine?
The InChIKey is JZMOHAITYZNLKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN2O/c15-11-6-7-14-16-8-12(17(14)9-11)10-18-13-4-2-1-3-5-13/h1-9H,10H2.
What are the key properties of 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine?
6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine has a molecular weight of 303.16 g/mol, XLogP of 3.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(phenoxymethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117256189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).