2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline

C23H15ClF3N — CID 11825462

IUPAC2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline
SMILESCc1ccc(-c2cc(-c3ccc(Cl)cc3)nc3ccc(C(F)(F)F)cc23)cc1
InChIInChI=1S/C23H15ClF3N/c1-14-2-4-15(5-3-14)19-13-22(16-6-9-18(24)10-7-16)28-21-11-8-17(12-20(19)21)23(25,26)27/h2-13H,1H3
InChIKeyVIZWCHWHEHUUIE-UHFFFAOYSA-N
MW397.83 g/mol
LogP7.55
Rot. Bonds2

About 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline

2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline (PubChem CID 11825462) has the molecular formula C23H15ClF3N and a molecular weight of 397.83 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline
PubChem CID11825462
Molecular FormulaC23H15ClF3N
Molecular Weight397.83 g/mol
Exact Mass397.08
IUPAC Name2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline
SMILESCc1ccc(-c2cc(-c3ccc(Cl)cc3)nc3ccc(C(F)(F)F)cc23)cc1
InChIInChI=1S/C23H15ClF3N/c1-14-2-4-15(5-3-14)19-13-22(16-6-9-18(24)10-7-16)28-21-11-8-17(12-20(19)21)23(25,26)27/h2-13H,1H3
InChIKeyVIZWCHWHEHUUIE-UHFFFAOYSA-N
XLogP7.55
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.83
LogP ≤ 57.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-chlorophenyl)-2-thiophen-3-yl-7-(trifluoromethyl)quinoline
CID 102412198
4-(4-chlorophenyl)-6-methoxy-2-(4-methoxyphenyl)quinoline
CID 11100859
6-chloro-2-(4-chlorophenyl)-4-(4-methoxyphenyl)quinoline
CID 12026464
2-(4-methoxyphenyl)-6-[2-[2-(4-methylphenyl)-4-phenylquinolin-6-yl]propan-2-yl]-4-phenylquinoline
CID 59685790
2-[4-(3-fluoro-5-methylphenyl)phenyl]-6-(trifluoromethyl)quinoline-4-carboxylic acid
CID 160851674
4-methyl-2-[4-(trifluoromethyl)phenyl]quinoline
CID 59274673
4-phenyl-2,6-bis(trifluoromethyl)quinoline
CID 135018944
1-chloro-2-(4-methylphenyl)-4-(trifluoromethyl)benzene
CID 162568601
3-chloro-6-(4-methylphenyl)-12-[4-(trifluoromethyl)phenyl]chrysene
CID 58501237
2-chloro-9-methyl-6-(trifluoromethyl)acridine
CID 146170270
4-(4-chlorophenyl)-2-(4-fluorophenyl)quinoline
CID 56807096
4-(4-chlorophenyl)-6-methoxy-2-(trifluoromethyl)quinoline
CID 135018951

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline?
The IUPAC name of 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline (CID 11825462) is 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline?
The canonical SMILES for 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline is Cc1ccc(-c2cc(-c3ccc(Cl)cc3)nc3ccc(C(F)(F)F)cc23)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline?
The InChIKey is VIZWCHWHEHUUIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15ClF3N/c1-14-2-4-15(5-3-14)19-13-22(16-6-9-18(24)10-7-16)28-21-11-8-17(12-20(19)21)23(25,26)27/h2-13H,1H3.
What are the key properties of 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline?
2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline has a molecular weight of 397.83 g/mol, XLogP of 7.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)quinoline is sourced from PubChem (CID 11825462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).