3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine

C8H6BrClN2 — CID 130064917

IUPAC3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine
SMILESCc1ccc(Cl)c2ncc(Br)n12
InChIInChI=1S/C8H6BrClN2/c1-5-2-3-6(10)8-11-4-7(9)12(5)8/h2-4H,1H3
InChIKeyBEODSMBLXRIRGB-UHFFFAOYSA-N
MW245.51 g/mol
LogP3.06
Rot. Bonds

About 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine

3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine (PubChem CID 130064917) has the molecular formula C8H6BrClN2 and a molecular weight of 245.51 g/mol. Its IUPAC name is 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine
PubChem CID130064917
Molecular FormulaC8H6BrClN2
Molecular Weight245.51 g/mol
Exact Mass243.94
IUPAC Name3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine
SMILESCc1ccc(Cl)c2ncc(Br)n12
InChIInChI=1S/C8H6BrClN2/c1-5-2-3-6(10)8-11-4-7(9)12(5)8/h2-4H,1H3
InChIKeyBEODSMBLXRIRGB-UHFFFAOYSA-N
XLogP3.06
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.51
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine?
The IUPAC name of 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine (CID 130064917) is 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine is Cc1ccc(Cl)c2ncc(Br)n12.
What is the InChIKey of 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine?
The InChIKey is BEODSMBLXRIRGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrClN2/c1-5-2-3-6(10)8-11-4-7(9)12(5)8/h2-4H,1H3.
What are the key properties of 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine?
3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine has a molecular weight of 245.51 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-8-chloro-5-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 130064917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).