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

C11H6ClF2N — CID 102824538

IUPAC2-(3-chloro-5-fluorophenyl)-4-fluoropyridine
SMILESFc1cc(Cl)cc(-c2cc(F)ccn2)c1
InChIInChI=1S/C11H6ClF2N/c12-8-3-7(4-10(14)5-8)11-6-9(13)1-2-15-11/h1-6H
InChIKeyYBDSLSSVYFBDAR-UHFFFAOYSA-N
MW225.63 g/mol
LogP3.68
Rot. Bonds1

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

2-(3-chloro-5-fluorophenyl)-4-fluoropyridine (PubChem CID 102824538) has the molecular formula C11H6ClF2N and a molecular weight of 225.63 g/mol. Its IUPAC name is 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine.

Molecular Properties

Compound Name2-(3-chloro-5-fluorophenyl)-4-fluoropyridine
PubChem CID102824538
Molecular FormulaC11H6ClF2N
Molecular Weight225.63 g/mol
Exact Mass225.02
IUPAC Name2-(3-chloro-5-fluorophenyl)-4-fluoropyridine
SMILESFc1cc(Cl)cc(-c2cc(F)ccn2)c1
InChIInChI=1S/C11H6ClF2N/c12-8-3-7(4-10(14)5-8)11-6-9(13)1-2-15-11/h1-6H
InChIKeyYBDSLSSVYFBDAR-UHFFFAOYSA-N
XLogP3.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.63
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine?
The IUPAC name of 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine (CID 102824538) is 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine.
What is the SMILES notation for 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine?
The canonical SMILES for 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine is Fc1cc(Cl)cc(-c2cc(F)ccn2)c1.
What is the InChIKey of 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine?
The InChIKey is YBDSLSSVYFBDAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF2N/c12-8-3-7(4-10(14)5-8)11-6-9(13)1-2-15-11/h1-6H.
What are the key properties of 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine?
2-(3-chloro-5-fluorophenyl)-4-fluoropyridine has a molecular weight of 225.63 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-5-fluorophenyl)-4-fluoropyridine is sourced from PubChem (CID 102824538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).