2-[4-(3-fluorophenyl)phenyl]quinoline

C21H14FN — CID 171056461

IUPAC2-[4-(3-fluorophenyl)phenyl]quinoline
SMILESFc1cccc(-c2ccc(-c3ccc4ccccc4n3)cc2)c1
InChIInChI=1S/C21H14FN/c22-19-6-3-5-18(14-19)15-8-10-17(11-9-15)21-13-12-16-4-1-2-7-20(16)23-21/h1-14H
InChIKeyCJYKJXLEPBWUIH-UHFFFAOYSA-N
MW299.35 g/mol
LogP5.71
Rot. Bonds2

About 2-[4-(3-fluorophenyl)phenyl]quinoline

2-[4-(3-fluorophenyl)phenyl]quinoline (PubChem CID 171056461) has the molecular formula C21H14FN and a molecular weight of 299.35 g/mol. Its IUPAC name is 2-[4-(3-fluorophenyl)phenyl]quinoline.

Molecular Properties

Compound Name2-[4-(3-fluorophenyl)phenyl]quinoline
PubChem CID171056461
Molecular FormulaC21H14FN
Molecular Weight299.35 g/mol
Exact Mass299.11
IUPAC Name2-[4-(3-fluorophenyl)phenyl]quinoline
SMILESFc1cccc(-c2ccc(-c3ccc4ccccc4n3)cc2)c1
InChIInChI=1S/C21H14FN/c22-19-6-3-5-18(14-19)15-8-10-17(11-9-15)21-13-12-16-4-1-2-7-20(16)23-21/h1-14H
InChIKeyCJYKJXLEPBWUIH-UHFFFAOYSA-N
XLogP5.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.35
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-fluorophenyl)phenyl]quinoline?
The IUPAC name of 2-[4-(3-fluorophenyl)phenyl]quinoline (CID 171056461) is 2-[4-(3-fluorophenyl)phenyl]quinoline.
What is the SMILES notation for 2-[4-(3-fluorophenyl)phenyl]quinoline?
The canonical SMILES for 2-[4-(3-fluorophenyl)phenyl]quinoline is Fc1cccc(-c2ccc(-c3ccc4ccccc4n3)cc2)c1.
What is the InChIKey of 2-[4-(3-fluorophenyl)phenyl]quinoline?
The InChIKey is CJYKJXLEPBWUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14FN/c22-19-6-3-5-18(14-19)15-8-10-17(11-9-15)21-13-12-16-4-1-2-7-20(16)23-21/h1-14H.
What are the key properties of 2-[4-(3-fluorophenyl)phenyl]quinoline?
2-[4-(3-fluorophenyl)phenyl]quinoline has a molecular weight of 299.35 g/mol, XLogP of 5.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-fluorophenyl)phenyl]quinoline is sourced from PubChem (CID 171056461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).