3-bromo-8-methoxyimidazo[1,2-a]pyridine

C8H7BrN2O — CID 76849488

IUPAC3-bromo-8-methoxyimidazo[1,2-a]pyridine
SMILESCOc1cccn2c(Br)cnc12
InChIInChI=1S/C8H7BrN2O/c1-12-6-3-2-4-11-7(9)5-10-8(6)11/h2-5H,1H3
InChIKeyAKXXJZFDYQKQDC-UHFFFAOYSA-N
MW227.06 g/mol
LogP2.11
Rot. Bonds1

About 3-bromo-8-methoxyimidazo[1,2-a]pyridine

3-bromo-8-methoxyimidazo[1,2-a]pyridine (PubChem CID 76849488) has the molecular formula C8H7BrN2O and a molecular weight of 227.06 g/mol. Its IUPAC name is 3-bromo-8-methoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-8-methoxyimidazo[1,2-a]pyridine
PubChem CID76849488
Molecular FormulaC8H7BrN2O
Molecular Weight227.06 g/mol
Exact Mass225.97
IUPAC Name3-bromo-8-methoxyimidazo[1,2-a]pyridine
SMILESCOc1cccn2c(Br)cnc12
InChIInChI=1S/C8H7BrN2O/c1-12-6-3-2-4-11-7(9)5-10-8(6)11/h2-5H,1H3
InChIKeyAKXXJZFDYQKQDC-UHFFFAOYSA-N
XLogP2.11
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.06
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-bromo-8-methoxyimidazo[1,2-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-bromo-8-methoxyimidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-8-methoxyimidazo[1,2-a]pyridine (CID 76849488) is 3-bromo-8-methoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-8-methoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-8-methoxyimidazo[1,2-a]pyridine is COc1cccn2c(Br)cnc12.
What is the InChIKey of 3-bromo-8-methoxyimidazo[1,2-a]pyridine?
The InChIKey is AKXXJZFDYQKQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrN2O/c1-12-6-3-2-4-11-7(9)5-10-8(6)11/h2-5H,1H3.
What are the key properties of 3-bromo-8-methoxyimidazo[1,2-a]pyridine?
3-bromo-8-methoxyimidazo[1,2-a]pyridine has a molecular weight of 227.06 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-8-methoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 76849488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).