4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline

C20H12ClFN2 — CID 139651658

IUPAC4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline
SMILESFc1ccc(-c2nc3ccccc3c(Cl)c2-c2ccncc2)cc1
InChIInChI=1S/C20H12ClFN2/c21-19-16-3-1-2-4-17(16)24-20(14-5-7-15(22)8-6-14)18(19)13-9-11-23-12-10-13/h1-12H
InChIKeyUDEZQSSSOFRXDJ-UHFFFAOYSA-N
MW334.78 g/mol
LogP5.76
Rot. Bonds2

About 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline

4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline (PubChem CID 139651658) has the molecular formula C20H12ClFN2 and a molecular weight of 334.78 g/mol. Its IUPAC name is 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline.

Molecular Properties

Compound Name4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline
PubChem CID139651658
Molecular FormulaC20H12ClFN2
Molecular Weight334.78 g/mol
Exact Mass334.07
IUPAC Name4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline
SMILESFc1ccc(-c2nc3ccccc3c(Cl)c2-c2ccncc2)cc1
InChIInChI=1S/C20H12ClFN2/c21-19-16-3-1-2-4-17(16)24-20(14-5-7-15(22)8-6-14)18(19)13-9-11-23-12-10-13/h1-12H
InChIKeyUDEZQSSSOFRXDJ-UHFFFAOYSA-N
XLogP5.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.78
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-6-fluoro-2-phenyl-3-pyridin-4-ylquinoline
CID 139651657
4-methoxy-2-phenyl-3-pyridin-4-ylquinoline
CID 139651635
3-chloro-2,4-diphenylquinoline
CID 10781654
7,14-dimethyl-6,13-bis(4-pyridin-4-ylphenyl)quinolino[4,3-j]phenanthridine
CID 134595926
2,4-dichloro-6-fluoro-3-phenylquinoline
CID 2780763
6,11-dipyridin-4-ylbenzo[b]phenazine
CID 154692257
2-[2-(2-chlorophenyl)ethylamino]-5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrimidin-6-one
CID 135703021
3-fluoro-2-phenyl-N-pyridin-4-ylquinolin-4-amine
CID 11301504
2-(5-chloro-2-fluorophenyl)-3-(4-fluorophenyl)quinoxaline
CID 123994326
4-(4-fluorophenyl)-N-methylquinazolin-2-amine
CID 156576968
2-(2,6-dimethylphenyl)-4-(4-fluorophenyl)pyrrolo[3,4-c]quinoline-1,3-dione
CID 102230062
3-[(2-phenyl-3-pyridin-4-ylquinolin-4-yl)amino]propanoic acid
CID 139651637

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline?
The IUPAC name of 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline (CID 139651658) is 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline.
What is the SMILES notation for 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline?
The canonical SMILES for 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline is Fc1ccc(-c2nc3ccccc3c(Cl)c2-c2ccncc2)cc1.
What is the InChIKey of 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline?
The InChIKey is UDEZQSSSOFRXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12ClFN2/c21-19-16-3-1-2-4-17(16)24-20(14-5-7-15(22)8-6-14)18(19)13-9-11-23-12-10-13/h1-12H.
What are the key properties of 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline?
4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline has a molecular weight of 334.78 g/mol, XLogP of 5.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline is sourced from PubChem (CID 139651658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).