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

C12H11BrN2 — CID 10901441

IUPAC3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine
SMILESCc1cccc(-c2ccc(Br)c(C)n2)n1
InChIInChI=1S/C12H11BrN2/c1-8-4-3-5-11(14-8)12-7-6-10(13)9(2)15-12/h3-7H,1-2H3
InChIKeyLDDPQAMHWCXEME-UHFFFAOYSA-N
MW263.14 g/mol
LogP3.52
Rot. Bonds1

About 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine

3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine (PubChem CID 10901441) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine
PubChem CID10901441
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine
SMILESCc1cccc(-c2ccc(Br)c(C)n2)n1
InChIInChI=1S/C12H11BrN2/c1-8-4-3-5-11(14-8)12-7-6-10(13)9(2)15-12/h3-7H,1-2H3
InChIKeyLDDPQAMHWCXEME-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

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine?
The IUPAC name of 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine (CID 10901441) is 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine.
What is the SMILES notation for 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine?
The canonical SMILES for 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine is Cc1cccc(-c2ccc(Br)c(C)n2)n1.
What is the InChIKey of 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine?
The InChIKey is LDDPQAMHWCXEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2/c1-8-4-3-5-11(14-8)12-7-6-10(13)9(2)15-12/h3-7H,1-2H3.
What are the key properties of 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine?
3-bromo-2-methyl-6-(6-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 3-bromo-2-methyl-6-(6-methyl-2-pyridinyl)pyridine is sourced from PubChem (CID 10901441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).