5-bromo-2-fluoropyridine

C10H6Br2F2N2 — CID 69000172

IUPAC5-bromo-2-fluoropyridine
SMILESFc1ccc(Br)cn1.Fc1ccc(Br)cn1
InChIInChI=1S/2C5H3BrFN/c2*6-4-1-2-5(7)8-3-4/h2*1-3H
InChIKeyZXYNQNULZBJPMA-UHFFFAOYSA-N
MW351.98 g/mol
LogP3.97
Rot. Bonds

About 5-bromo-2-fluoropyridine

5-bromo-2-fluoropyridine (PubChem CID 69000172) has the molecular formula C10H6Br2F2N2 and a molecular weight of 351.98 g/mol. Its IUPAC name is 5-bromo-2-fluoropyridine.

Molecular Properties

Compound Name5-bromo-2-fluoropyridine
PubChem CID69000172
Molecular FormulaC10H6Br2F2N2
Molecular Weight351.98 g/mol
Exact Mass349.89
IUPAC Name5-bromo-2-fluoropyridine
SMILESFc1ccc(Br)cn1.Fc1ccc(Br)cn1
InChIInChI=1S/2C5H3BrFN/c2*6-4-1-2-5(7)8-3-4/h2*1-3H
InChIKeyZXYNQNULZBJPMA-UHFFFAOYSA-N
XLogP3.97
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.98
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 5-bromo-2-fluoropyridine?
The IUPAC name of 5-bromo-2-fluoropyridine (CID 69000172) is 5-bromo-2-fluoropyridine.
What is the SMILES notation for 5-bromo-2-fluoropyridine?
The canonical SMILES for 5-bromo-2-fluoropyridine is Fc1ccc(Br)cn1.Fc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-2-fluoropyridine?
The InChIKey is ZXYNQNULZBJPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H3BrFN/c2*6-4-1-2-5(7)8-3-4/h2*1-3H.
What are the key properties of 5-bromo-2-fluoropyridine?
5-bromo-2-fluoropyridine has a molecular weight of 351.98 g/mol, XLogP of 3.97, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-fluoropyridine is sourced from PubChem (CID 69000172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).