6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline

C18H14F3NO2 — CID 135018947

IUPAC6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline
SMILESCOc1ccc(-c2cc(C(F)(F)F)nc3ccc(OC)cc23)cc1
InChIInChI=1S/C18H14F3NO2/c1-23-12-5-3-11(4-6-12)14-10-17(18(19,20)21)22-16-8-7-13(24-2)9-15(14)16/h3-10H,1-2H3
InChIKeyAHIPAXYJZPYWDG-UHFFFAOYSA-N
MW333.31 g/mol
LogP4.94
Rot. Bonds3

About 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline

6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline (PubChem CID 135018947) has the molecular formula C18H14F3NO2 and a molecular weight of 333.31 g/mol. Its IUPAC name is 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline
PubChem CID135018947
Molecular FormulaC18H14F3NO2
Molecular Weight333.31 g/mol
Exact Mass333.10
IUPAC Name6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline
SMILESCOc1ccc(-c2cc(C(F)(F)F)nc3ccc(OC)cc23)cc1
InChIInChI=1S/C18H14F3NO2/c1-23-12-5-3-11(4-6-12)14-10-17(18(19,20)21)22-16-8-7-13(24-2)9-15(14)16/h3-10H,1-2H3
InChIKeyAHIPAXYJZPYWDG-UHFFFAOYSA-N
XLogP4.94
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.31
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-chlorophenyl)-6-methoxy-2-(trifluoromethyl)quinoline
CID 135018951
4-(difluoromethyl)-6-methoxy-2-(trifluoromethyl)quinoline
CID 130248319
6-methoxy-2-methyl-4-(4-methylphenyl)quinoline
CID 101221850
4-(4-chlorophenyl)-6-methoxy-2-(4-methoxyphenyl)quinoline
CID 11100859
6-methoxy-2-methyl-4-phenylquinoline
CID 12787220
4-phenyl-2,6-bis(trifluoromethyl)quinoline
CID 135018944
[2-(4-methoxyphenyl)-4-(4-methylphenyl)-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 91926587
6-methoxy-1-methyl-3-(trifluoromethyl)isoquinoline
CID 154488566
7-methyl-4-phenyl-2-(trifluoromethyl)quinoline
CID 15213749
6-chloro-2-(4-chlorophenyl)-4-(4-methoxyphenyl)quinoline
CID 12026464
2-tert-butyl-6-methoxyquinolin-4-amine
CID 55045942
6-methoxy-4-(4-methoxyphenyl)-2-phenylquinazoline
CID 101425277

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline?
The IUPAC name of 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline (CID 135018947) is 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline.
What is the SMILES notation for 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline?
The canonical SMILES for 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline is COc1ccc(-c2cc(C(F)(F)F)nc3ccc(OC)cc23)cc1.
What is the InChIKey of 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline?
The InChIKey is AHIPAXYJZPYWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3NO2/c1-23-12-5-3-11(4-6-12)14-10-17(18(19,20)21)22-16-8-7-13(24-2)9-15(14)16/h3-10H,1-2H3.
What are the key properties of 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline?
6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline has a molecular weight of 333.31 g/mol, XLogP of 4.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-(4-methoxyphenyl)-2-(trifluoromethyl)quinoline is sourced from PubChem (CID 135018947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).