2-bromo-3-methylpyridine;zinc

C6H6BrNZn — CID 87255964

IUPAC2-bromo-3-methylpyridine;zinc
SMILESCc1cccnc1Br.[Zn]
InChIInChI=1S/C6H6BrN.Zn/c1-5-3-2-4-8-6(5)7;/h2-4H,1H3;
InChIKeyLLTZSZIWJJIMRF-UHFFFAOYSA-N
MW237.41 g/mol
LogP2.15
Rot. Bonds

About 2-bromo-3-methylpyridine;zinc

2-bromo-3-methylpyridine;zinc (PubChem CID 87255964) has the molecular formula C6H6BrNZn and a molecular weight of 237.41 g/mol. Its IUPAC name is 2-bromo-3-methylpyridine;zinc.

Molecular Properties

Compound Name2-bromo-3-methylpyridine;zinc
PubChem CID87255964
Molecular FormulaC6H6BrNZn
Molecular Weight237.41 g/mol
Exact Mass234.90
IUPAC Name2-bromo-3-methylpyridine;zinc
SMILESCc1cccnc1Br.[Zn]
InChIInChI=1S/C6H6BrN.Zn/c1-5-3-2-4-8-6(5)7;/h2-4H,1H3;
InChIKeyLLTZSZIWJJIMRF-UHFFFAOYSA-N
XLogP2.15
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-3-methylpyridine;ethane
CID 143610978
2-bromo-3-methylpyridine;3-chloro-2-methylpyridine;2-methyl-3-(trifluoromethyl)pyridine
CID 157346640
methoxymethane;3-methylpyridin-2-amine
CID 142348172
bis(2,3-dimethylpyridine);ethane
CID 159594018
2-bromo-3-propan-2-ylpyridine
CID 23436869
2-(3,5-dibromophenyl)-3-methylpyridine
CID 155769988
2-[(1R)-1-bromoethyl]-3-methylpyridine
CID 124561597
2-bromo-3-[2-(2-bromo-3-pyridinyl)ethynyl]pyridine
CID 24874157
2,3-dimethylpyridine;1,4-xylene
CID 174745079
2-bromo-N-(2-bromo-3-methylphenyl)pyridine-3-carboxamide
CID 104870910
2-bromo-3-[(2-methylpropan-2-yl)oxy]pyridine
CID 10585519
1-(2-bromo-3-pyridinyl)butan-1-one
CID 14343356

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-methylpyridine;zinc?
The IUPAC name of 2-bromo-3-methylpyridine;zinc (CID 87255964) is 2-bromo-3-methylpyridine;zinc.
What is the SMILES notation for 2-bromo-3-methylpyridine;zinc?
The canonical SMILES for 2-bromo-3-methylpyridine;zinc is Cc1cccnc1Br.[Zn].
What is the InChIKey of 2-bromo-3-methylpyridine;zinc?
The InChIKey is LLTZSZIWJJIMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrN.Zn/c1-5-3-2-4-8-6(5)7;/h2-4H,1H3;.
What are the key properties of 2-bromo-3-methylpyridine;zinc?
2-bromo-3-methylpyridine;zinc has a molecular weight of 237.41 g/mol, XLogP of 2.15, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-methylpyridine;zinc is sourced from PubChem (CID 87255964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).