zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride

C7H8ClNZn — CID 21285530

IUPACzinc;2,6-dimethyl-3H-pyridin-3-ide;chloride
SMILESCc1[c-]ccc(C)n1.[Cl-].[Zn+2]
InChIInChI=1S/C7H8N.ClH.Zn/c1-6-4-3-5-7(2)8-6;;/h3-4H,1-2H3;1H;/q-1;;+2/p-1
InChIKeyFXAMSQQOWJSGBO-UHFFFAOYSA-M
MW206.99 g/mol
LogP-1.50
Rot. Bonds

About zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride

zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride (PubChem CID 21285530) has the molecular formula C7H8ClNZn and a molecular weight of 206.99 g/mol. Its IUPAC name is zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride.

Molecular Properties

Compound Namezinc;2,6-dimethyl-3H-pyridin-3-ide;chloride
PubChem CID21285530
Molecular FormulaC7H8ClNZn
Molecular Weight206.99 g/mol
Exact Mass204.96
IUPAC Namezinc;2,6-dimethyl-3H-pyridin-3-ide;chloride
SMILESCc1[c-]ccc(C)n1.[Cl-].[Zn+2]
InChIInChI=1S/C7H8N.ClH.Zn/c1-6-4-3-5-7(2)8-6;;/h3-4H,1-2H3;1H;/q-1;;+2/p-1
InChIKeyFXAMSQQOWJSGBO-UHFFFAOYSA-M
XLogP-1.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.99
LogP ≤ 5-1.50
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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Frequently Asked Questions

What is the IUPAC name of zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride?
The IUPAC name of zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride (CID 21285530) is zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride.
What is the SMILES notation for zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride?
The canonical SMILES for zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride is Cc1[c-]ccc(C)n1.[Cl-].[Zn+2].
What is the InChIKey of zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride?
The InChIKey is FXAMSQQOWJSGBO-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H8N.ClH.Zn/c1-6-4-3-5-7(2)8-6;;/h3-4H,1-2H3;1H;/q-1;;+2/p-1.
What are the key properties of zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride?
zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride has a molecular weight of 206.99 g/mol, XLogP of -1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;2,6-dimethyl-3H-pyridin-3-ide;chloride is sourced from PubChem (CID 21285530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).