1,7-dibromo-3-methylimidazo[1,5-a]pyridine

C8H6Br2N2 — CID 84743743

IUPAC1,7-dibromo-3-methylimidazo[1,5-a]pyridine
SMILESCc1nc(Br)c2cc(Br)ccn12
InChIInChI=1S/C8H6Br2N2/c1-5-11-8(10)7-4-6(9)2-3-12(5)7/h2-4H,1H3
InChIKeyRRNOGRQGJSTXTQ-UHFFFAOYSA-N
MW289.96 g/mol
LogP3.17
Rot. Bonds

About 1,7-dibromo-3-methylimidazo[1,5-a]pyridine

1,7-dibromo-3-methylimidazo[1,5-a]pyridine (PubChem CID 84743743) has the molecular formula C8H6Br2N2 and a molecular weight of 289.96 g/mol. Its IUPAC name is 1,7-dibromo-3-methylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1,7-dibromo-3-methylimidazo[1,5-a]pyridine
PubChem CID84743743
Molecular FormulaC8H6Br2N2
Molecular Weight289.96 g/mol
Exact Mass287.89
IUPAC Name1,7-dibromo-3-methylimidazo[1,5-a]pyridine
SMILESCc1nc(Br)c2cc(Br)ccn12
InChIInChI=1S/C8H6Br2N2/c1-5-11-8(10)7-4-6(9)2-3-12(5)7/h2-4H,1H3
InChIKeyRRNOGRQGJSTXTQ-UHFFFAOYSA-N
XLogP3.17
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.96
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,7-dibromo-3-methylimidazo[1,5-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 1,7-dibromo-3-methylimidazo[1,5-a]pyridine?
The IUPAC name of 1,7-dibromo-3-methylimidazo[1,5-a]pyridine (CID 84743743) is 1,7-dibromo-3-methylimidazo[1,5-a]pyridine.
What is the SMILES notation for 1,7-dibromo-3-methylimidazo[1,5-a]pyridine?
The canonical SMILES for 1,7-dibromo-3-methylimidazo[1,5-a]pyridine is Cc1nc(Br)c2cc(Br)ccn12.
What is the InChIKey of 1,7-dibromo-3-methylimidazo[1,5-a]pyridine?
The InChIKey is RRNOGRQGJSTXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Br2N2/c1-5-11-8(10)7-4-6(9)2-3-12(5)7/h2-4H,1H3.
What are the key properties of 1,7-dibromo-3-methylimidazo[1,5-a]pyridine?
1,7-dibromo-3-methylimidazo[1,5-a]pyridine has a molecular weight of 289.96 g/mol, XLogP of 3.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dibromo-3-methylimidazo[1,5-a]pyridine is sourced from PubChem (CID 84743743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).