2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine

C12H11BrN2 — CID 53438778

IUPAC2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine
SMILESCc1ccnc(-c2cc(C)cc(Br)n2)c1
InChIInChI=1S/C12H11BrN2/c1-8-3-4-14-10(5-8)11-6-9(2)7-12(13)15-11/h3-7H,1-2H3
InChIKeyUEJJXCRFGURPDR-UHFFFAOYSA-N
MW263.14 g/mol
LogP3.52
Rot. Bonds1

About 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine

2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine (PubChem CID 53438778) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine
PubChem CID53438778
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine
SMILESCc1ccnc(-c2cc(C)cc(Br)n2)c1
InChIInChI=1S/C12H11BrN2/c1-8-3-4-14-10(5-8)11-6-9(2)7-12(13)15-11/h3-7H,1-2H3
InChIKeyUEJJXCRFGURPDR-UHFFFAOYSA-N
XLogP3.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.14
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)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 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine?
The IUPAC name of 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine (CID 53438778) is 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine.
What is the SMILES notation for 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine?
The canonical SMILES for 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine is Cc1ccnc(-c2cc(C)cc(Br)n2)c1.
What is the InChIKey of 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine?
The InChIKey is UEJJXCRFGURPDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2/c1-8-3-4-14-10(5-8)11-6-9(2)7-12(13)15-11/h3-7H,1-2H3.
What are the key properties of 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine?
2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine has a molecular weight of 263.14 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-methyl-6-(4-methyl-2-pyridinyl)pyridine is sourced from PubChem (CID 53438778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).