3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline

C32H20F3N — CID 169293864

IUPAC3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cnc3c2)cc1
InChIInChI=1S/C32H20F3N/c33-32(34,35)30-15-13-23(14-16-30)27-11-12-28-18-29(20-36-31(28)19-27)24-7-5-22(6-8-24)26-10-9-21-3-1-2-4-25(21)17-26/h1-20H
InChIKeyAZRVACWOZOTXGO-UHFFFAOYSA-N
MW475.51 g/mol
LogP9.41
Rot. Bonds3

About 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline

3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline (PubChem CID 169293864) has the molecular formula C32H20F3N and a molecular weight of 475.51 g/mol. Its IUPAC name is 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline.

Molecular Properties

Compound Name3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
PubChem CID169293864
Molecular FormulaC32H20F3N
Molecular Weight475.51 g/mol
Exact Mass475.15
IUPAC Name3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cnc3c2)cc1
InChIInChI=1S/C32H20F3N/c33-32(34,35)30-15-13-23(14-16-30)27-11-12-28-18-29(20-36-31(28)19-27)24-7-5-22(6-8-24)26-10-9-21-3-1-2-4-25(21)17-26/h1-20H
InChIKeyAZRVACWOZOTXGO-UHFFFAOYSA-N
XLogP9.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.51
LogP ≤ 59.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-quinolin-3-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293562
3-(4-naphthalen-1-ylphenyl)-7-[4-[4-(trifluoromethyl)phenyl]phenyl]quinoline
CID 169293894
trimethyl-[4-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]phenyl]silane
CID 169293948
trimethyl-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]silane
CID 169293955
2-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]naphthalene
CID 171056262
2-[4-(trifluoromethyl)phenyl]naphthalene
CID 11448652
3-phenyl-7-(trifluoromethyl)quinoline
CID 86031404
2-naphthalen-2-yl-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
CID 169293608
7-[4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3-(4-quinolin-3-ylphenyl)quinoline
CID 170295226
3-(4-dibenzothiophen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293563
3-[4-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]phenyl]quinoline
CID 171056228
7-[3,5-bis(trifluoromethyl)phenyl]-3-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]quinoline
CID 169293501

Frequently Asked Questions

What is the IUPAC name of 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The IUPAC name of 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline (CID 169293864) is 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline.
What is the SMILES notation for 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The canonical SMILES for 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline is FC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cnc3c2)cc1.
What is the InChIKey of 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The InChIKey is AZRVACWOZOTXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20F3N/c33-32(34,35)30-15-13-23(14-16-30)27-11-12-28-18-29(20-36-31(28)19-27)24-7-5-22(6-8-24)26-10-9-21-3-1-2-4-25(21)17-26/h1-20H.
What are the key properties of 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline has a molecular weight of 475.51 g/mol, XLogP of 9.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline is sourced from PubChem (CID 169293864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).