3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline

C30H18F3N3 — CID 169293945

IUPAC3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5cccc6cccnc56)nc4)cnc3c2)cc1
InChIInChI=1S/C30H18F3N3/c31-30(32,33)25-11-8-19(9-12-25)21-6-7-22-15-24(18-36-28(22)16-21)23-10-13-27(35-17-23)26-5-1-3-20-4-2-14-34-29(20)26/h1-18H
InChIKeyUKVAIDRFWFTRTP-UHFFFAOYSA-N
MW477.49 g/mol
LogP8.20
Rot. Bonds3

About 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline

3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline (PubChem CID 169293945) has the molecular formula C30H18F3N3 and a molecular weight of 477.49 g/mol. Its IUPAC name is 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline.

Molecular Properties

Compound Name3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline
PubChem CID169293945
Molecular FormulaC30H18F3N3
Molecular Weight477.49 g/mol
Exact Mass477.15
IUPAC Name3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5cccc6cccnc56)nc4)cnc3c2)cc1
InChIInChI=1S/C30H18F3N3/c31-30(32,33)25-11-8-19(9-12-25)21-6-7-22-15-24(18-36-28(22)16-21)23-10-13-27(35-17-23)26-5-1-3-20-4-2-14-34-29(20)26/h1-18H
InChIKeyUKVAIDRFWFTRTP-UHFFFAOYSA-N
XLogP8.20
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.49
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-naphthalen-2-ylphenyl)-7-[4-(trifluoromethyl)phenyl]quinoline
CID 169293864
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
7-[3,5-bis(trifluoromethyl)phenyl]-3-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]quinoline
CID 169293501
2-naphthalen-2-yl-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
CID 169293608
2-[4-(trifluoromethyl)phenyl]-5-[6-[4-(trifluoromethyl)phenyl]naphthalen-2-yl]pyridine
CID 169293774
trimethyl-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]silane
CID 169293955
trimethyl-[4-[4-[3-[4-[4-(trifluoromethyl)phenyl]phenyl]quinolin-7-yl]phenyl]phenyl]silane
CID 169293948
7-[4-[3,5-bis(trifluoromethyl)phenyl]phenyl]-3-(4-pyridin-2-ylphenyl)quinoline
CID 169293936
7-[3,5-bis(trifluoromethyl)phenyl]-3-(4-pyridin-2-ylphenyl)quinoline
CID 169293842
8-[5-[7-(4-fluorophenyl)quinolin-3-yl]-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 169293885
3-[6-[3-(4-phenylphenyl)-5-quinolin-8-ylphenyl]-3-pyridinyl]-1,10-phenanthroline
CID 171459977

Frequently Asked Questions

What is the IUPAC name of 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The IUPAC name of 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline (CID 169293945) is 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline.
What is the SMILES notation for 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The canonical SMILES for 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline is FC(F)(F)c1ccc(-c2ccc3cc(-c4ccc(-c5cccc6cccnc56)nc4)cnc3c2)cc1.
What is the InChIKey of 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
The InChIKey is UKVAIDRFWFTRTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18F3N3/c31-30(32,33)25-11-8-19(9-12-25)21-6-7-22-15-24(18-36-28(22)16-21)23-10-13-27(35-17-23)26-5-1-3-20-4-2-14-34-29(20)26/h1-18H.
What are the key properties of 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline?
3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline has a molecular weight of 477.49 g/mol, XLogP of 8.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-quinolin-8-yl-3-pyridinyl)-7-[4-(trifluoromethyl)phenyl]quinoline is sourced from PubChem (CID 169293945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).