zinc;4-methyl-2H-pyridin-2-ide;bromide

C6H6BrNZn — CID 76530191

IUPACzinc;4-methyl-2H-pyridin-2-ide;bromide
SMILESCc1c[c-]ncc1.[Br-].[Zn+2]
InChIInChI=1S/C6H6N.BrH.Zn/c1-6-2-4-7-5-3-6;;/h2-4H,1H3;1H;/q-1;;+2/p-1
InChIKeyLSKVNRHSNXUCHS-UHFFFAOYSA-M
MW237.41 g/mol
LogP-1.81
Rot. Bonds

About zinc;4-methyl-2H-pyridin-2-ide;bromide

zinc;4-methyl-2H-pyridin-2-ide;bromide (PubChem CID 76530191) has the molecular formula C6H6BrNZn and a molecular weight of 237.41 g/mol. Its IUPAC name is zinc;4-methyl-2H-pyridin-2-ide;bromide.

Molecular Properties

Compound Namezinc;4-methyl-2H-pyridin-2-ide;bromide
PubChem CID76530191
Molecular FormulaC6H6BrNZn
Molecular Weight237.41 g/mol
Exact Mass234.90
IUPAC Namezinc;4-methyl-2H-pyridin-2-ide;bromide
SMILESCc1c[c-]ncc1.[Br-].[Zn+2]
InChIInChI=1S/C6H6N.BrH.Zn/c1-6-2-4-7-5-3-6;;/h2-4H,1H3;1H;/q-1;;+2/p-1
InChIKeyLSKVNRHSNXUCHS-UHFFFAOYSA-M
XLogP-1.81
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 ≤ 5-1.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

4-Methyl-2-pyridylzinc bromide solution
CID 6418566
Bromozinc(1+) 3-methylpyridin-2-ide
CID 16133065
4-Methyl-2-pyridylzinc bromide
CID 57377042
Lithium 5-methylpyridin-2-ide
CID 15815864
5-Methyl-2-pyridylzinc bromide
CID 6411545
4-Methyl-2-pyridyllithium
CID 16182949
4-methyl-2H-pyridin-2-ide
CID 125458985
4-Vinylpyridine-ZINC chloride
CID 129716684
4-Trifluoromethyl-2-pyridylzinc bromide
CID 133144670
5-Methyl-pyridinyl ZINC bromide
CID 22147986
5-Methyl-2-pyridylmagnesium bromide
CID 24722681
4-Methyl-2-pyridylmagnesium bromide
CID 24722682

Frequently Asked Questions

What is the IUPAC name of zinc;4-methyl-2H-pyridin-2-ide;bromide?
The IUPAC name of zinc;4-methyl-2H-pyridin-2-ide;bromide (CID 76530191) is zinc;4-methyl-2H-pyridin-2-ide;bromide.
What is the SMILES notation for zinc;4-methyl-2H-pyridin-2-ide;bromide?
The canonical SMILES for zinc;4-methyl-2H-pyridin-2-ide;bromide is Cc1c[c-]ncc1.[Br-].[Zn+2].
What is the InChIKey of zinc;4-methyl-2H-pyridin-2-ide;bromide?
The InChIKey is LSKVNRHSNXUCHS-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H6N.BrH.Zn/c1-6-2-4-7-5-3-6;;/h2-4H,1H3;1H;/q-1;;+2/p-1.
What are the key properties of zinc;4-methyl-2H-pyridin-2-ide;bromide?
zinc;4-methyl-2H-pyridin-2-ide;bromide has a molecular weight of 237.41 g/mol, XLogP of -1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;4-methyl-2H-pyridin-2-ide;bromide is sourced from PubChem (CID 76530191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).