zinc;5-fluoro-2H-pyridin-2-ide;bromide

C5H3BrFNZn — CID 86612379

IUPACzinc;5-fluoro-2H-pyridin-2-ide;bromide
SMILESFc1cc[c-]nc1.[Br-].[Zn+2]
InChIInChI=1S/C5H3FN.BrH.Zn/c6-5-2-1-3-7-4-5;;/h1-2,4H;1H;/q-1;;+2/p-1
InChIKeyZXEMYAUVTNVFKL-UHFFFAOYSA-M
MW241.38 g/mol
LogP-1.98
Rot. Bonds

About zinc;5-fluoro-2H-pyridin-2-ide;bromide

zinc;5-fluoro-2H-pyridin-2-ide;bromide (PubChem CID 86612379) has the molecular formula C5H3BrFNZn and a molecular weight of 241.38 g/mol. Its IUPAC name is zinc;5-fluoro-2H-pyridin-2-ide;bromide.

Molecular Properties

Compound Namezinc;5-fluoro-2H-pyridin-2-ide;bromide
PubChem CID86612379
Molecular FormulaC5H3BrFNZn
Molecular Weight241.38 g/mol
Exact Mass238.87
IUPAC Namezinc;5-fluoro-2H-pyridin-2-ide;bromide
SMILESFc1cc[c-]nc1.[Br-].[Zn+2]
InChIInChI=1S/C5H3FN.BrH.Zn/c6-5-2-1-3-7-4-5;;/h1-2,4H;1H;/q-1;;+2/p-1
InChIKeyZXEMYAUVTNVFKL-UHFFFAOYSA-M
XLogP-1.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 5-1.98
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;5-fluoro-2H-pyridin-2-ide;bromide?
The IUPAC name of zinc;5-fluoro-2H-pyridin-2-ide;bromide (CID 86612379) is zinc;5-fluoro-2H-pyridin-2-ide;bromide.
What is the SMILES notation for zinc;5-fluoro-2H-pyridin-2-ide;bromide?
The canonical SMILES for zinc;5-fluoro-2H-pyridin-2-ide;bromide is Fc1cc[c-]nc1.[Br-].[Zn+2].
What is the InChIKey of zinc;5-fluoro-2H-pyridin-2-ide;bromide?
The InChIKey is ZXEMYAUVTNVFKL-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H3FN.BrH.Zn/c6-5-2-1-3-7-4-5;;/h1-2,4H;1H;/q-1;;+2/p-1.
What are the key properties of zinc;5-fluoro-2H-pyridin-2-ide;bromide?
zinc;5-fluoro-2H-pyridin-2-ide;bromide has a molecular weight of 241.38 g/mol, XLogP of -1.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;5-fluoro-2H-pyridin-2-ide;bromide is sourced from PubChem (CID 86612379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).