2,6-dibromo-3-fluoropyridine

C5H2Br2FN — CID 52911237

IUPAC2,6-dibromo-3-fluoropyridine
SMILESFc1ccc(Br)nc1Br
InChIInChI=1S/C5H2Br2FN/c6-4-2-1-3(8)5(7)9-4/h1-2H
InChIKeyGOAOEPAQKOERAT-UHFFFAOYSA-N
MW254.88 g/mol
LogP2.75
Rot. Bonds

About 2,6-dibromo-3-fluoropyridine

2,6-dibromo-3-fluoropyridine (PubChem CID 52911237) has the molecular formula C5H2Br2FN and a molecular weight of 254.88 g/mol. Its IUPAC name is 2,6-dibromo-3-fluoropyridine.

Molecular Properties

Compound Name2,6-dibromo-3-fluoropyridine
PubChem CID52911237
Molecular FormulaC5H2Br2FN
Molecular Weight254.88 g/mol
Exact Mass252.85
IUPAC Name2,6-dibromo-3-fluoropyridine
SMILESFc1ccc(Br)nc1Br
InChIInChI=1S/C5H2Br2FN/c6-4-2-1-3(8)5(7)9-4/h1-2H
InChIKeyGOAOEPAQKOERAT-UHFFFAOYSA-N
XLogP2.75
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.88
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,6-dibromo-3-fluoropyridine?
The IUPAC name of 2,6-dibromo-3-fluoropyridine (CID 52911237) is 2,6-dibromo-3-fluoropyridine.
What is the SMILES notation for 2,6-dibromo-3-fluoropyridine?
The canonical SMILES for 2,6-dibromo-3-fluoropyridine is Fc1ccc(Br)nc1Br.
What is the InChIKey of 2,6-dibromo-3-fluoropyridine?
The InChIKey is GOAOEPAQKOERAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2Br2FN/c6-4-2-1-3(8)5(7)9-4/h1-2H.
What are the key properties of 2,6-dibromo-3-fluoropyridine?
2,6-dibromo-3-fluoropyridine has a molecular weight of 254.88 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromo-3-fluoropyridine is sourced from PubChem (CID 52911237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).