2-(4-fluoro-2-iodophenyl)quinoline

C15H9FIN — CID 163529104

IUPAC2-(4-fluoro-2-iodophenyl)quinoline
SMILESFc1ccc(-c2ccc3ccccc3n2)c(I)c1
InChIInChI=1S/C15H9FIN/c16-11-6-7-12(13(17)9-11)15-8-5-10-3-1-2-4-14(10)18-15/h1-9H
InChIKeyDRJIXWPFDBKAHJ-UHFFFAOYSA-N
MW349.15 g/mol
LogP4.65
Rot. Bonds1

About 2-(4-fluoro-2-iodophenyl)quinoline

2-(4-fluoro-2-iodophenyl)quinoline (PubChem CID 163529104) has the molecular formula C15H9FIN and a molecular weight of 349.15 g/mol. Its IUPAC name is 2-(4-fluoro-2-iodophenyl)quinoline.

Molecular Properties

Compound Name2-(4-fluoro-2-iodophenyl)quinoline
PubChem CID163529104
Molecular FormulaC15H9FIN
Molecular Weight349.15 g/mol
Exact Mass348.98
IUPAC Name2-(4-fluoro-2-iodophenyl)quinoline
SMILESFc1ccc(-c2ccc3ccccc3n2)c(I)c1
InChIInChI=1S/C15H9FIN/c16-11-6-7-12(13(17)9-11)15-8-5-10-3-1-2-4-14(10)18-15/h1-9H
InChIKeyDRJIXWPFDBKAHJ-UHFFFAOYSA-N
XLogP4.65
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.15
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-iodophenyl)quinoline?
The IUPAC name of 2-(4-fluoro-2-iodophenyl)quinoline (CID 163529104) is 2-(4-fluoro-2-iodophenyl)quinoline.
What is the SMILES notation for 2-(4-fluoro-2-iodophenyl)quinoline?
The canonical SMILES for 2-(4-fluoro-2-iodophenyl)quinoline is Fc1ccc(-c2ccc3ccccc3n2)c(I)c1.
What is the InChIKey of 2-(4-fluoro-2-iodophenyl)quinoline?
The InChIKey is DRJIXWPFDBKAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9FIN/c16-11-6-7-12(13(17)9-11)15-8-5-10-3-1-2-4-14(10)18-15/h1-9H.
What are the key properties of 2-(4-fluoro-2-iodophenyl)quinoline?
2-(4-fluoro-2-iodophenyl)quinoline has a molecular weight of 349.15 g/mol, XLogP of 4.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-iodophenyl)quinoline is sourced from PubChem (CID 163529104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).