2,4-dibromo-6-methylpyridine

C6H5Br2N — CID 12643720

IUPAC2,4-dibromo-6-methylpyridine
SMILESCc1cc(Br)cc(Br)n1
InChIInChI=1S/C6H5Br2N/c1-4-2-5(7)3-6(8)9-4/h2-3H,1H3
InChIKeyQNIQGMJOZQYBOX-UHFFFAOYSA-N
MW250.92 g/mol
LogP2.92
Rot. Bonds

About 2,4-dibromo-6-methylpyridine

2,4-dibromo-6-methylpyridine (PubChem CID 12643720) has the molecular formula C6H5Br2N and a molecular weight of 250.92 g/mol. Its IUPAC name is 2,4-dibromo-6-methylpyridine.

Molecular Properties

Compound Name2,4-dibromo-6-methylpyridine
PubChem CID12643720
Molecular FormulaC6H5Br2N
Molecular Weight250.92 g/mol
Exact Mass248.88
IUPAC Name2,4-dibromo-6-methylpyridine
SMILESCc1cc(Br)cc(Br)n1
InChIInChI=1S/C6H5Br2N/c1-4-2-5(7)3-6(8)9-4/h2-3H,1H3
InChIKeyQNIQGMJOZQYBOX-UHFFFAOYSA-N
XLogP2.92
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.92
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,4-dibromo-6-methylpyridine 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 2,4-dibromo-6-methylpyridine?
The IUPAC name of 2,4-dibromo-6-methylpyridine (CID 12643720) is 2,4-dibromo-6-methylpyridine.
What is the SMILES notation for 2,4-dibromo-6-methylpyridine?
The canonical SMILES for 2,4-dibromo-6-methylpyridine is Cc1cc(Br)cc(Br)n1.
What is the InChIKey of 2,4-dibromo-6-methylpyridine?
The InChIKey is QNIQGMJOZQYBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Br2N/c1-4-2-5(7)3-6(8)9-4/h2-3H,1H3.
What are the key properties of 2,4-dibromo-6-methylpyridine?
2,4-dibromo-6-methylpyridine has a molecular weight of 250.92 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-6-methylpyridine is sourced from PubChem (CID 12643720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).