4-(5-bromo-2-fluorophenyl)-3-fluoropyridine

C11H6BrF2N — CID 22285288

IUPAC4-(5-bromo-2-fluorophenyl)-3-fluoropyridine
SMILESFc1cnccc1-c1cc(Br)ccc1F
InChIInChI=1S/C11H6BrF2N/c12-7-1-2-10(13)9(5-7)8-3-4-15-6-11(8)14/h1-6H
InChIKeyKTZGEAHZCQHYEI-UHFFFAOYSA-N
MW270.08 g/mol
LogP3.79
Rot. Bonds1

About 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine

4-(5-bromo-2-fluorophenyl)-3-fluoropyridine (PubChem CID 22285288) has the molecular formula C11H6BrF2N and a molecular weight of 270.08 g/mol. Its IUPAC name is 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine.

Molecular Properties

Compound Name4-(5-bromo-2-fluorophenyl)-3-fluoropyridine
PubChem CID22285288
Molecular FormulaC11H6BrF2N
Molecular Weight270.08 g/mol
Exact Mass268.97
IUPAC Name4-(5-bromo-2-fluorophenyl)-3-fluoropyridine
SMILESFc1cnccc1-c1cc(Br)ccc1F
InChIInChI=1S/C11H6BrF2N/c12-7-1-2-10(13)9(5-7)8-3-4-15-6-11(8)14/h1-6H
InChIKeyKTZGEAHZCQHYEI-UHFFFAOYSA-N
XLogP3.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.08
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine?
The IUPAC name of 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine (CID 22285288) is 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine.
What is the SMILES notation for 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine?
The canonical SMILES for 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine is Fc1cnccc1-c1cc(Br)ccc1F.
What is the InChIKey of 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine?
The InChIKey is KTZGEAHZCQHYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrF2N/c12-7-1-2-10(13)9(5-7)8-3-4-15-6-11(8)14/h1-6H.
What are the key properties of 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine?
4-(5-bromo-2-fluorophenyl)-3-fluoropyridine has a molecular weight of 270.08 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromo-2-fluorophenyl)-3-fluoropyridine is sourced from PubChem (CID 22285288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).