6-[6-(trifluoromethyl)-3-pyridinyl]quinoline

C15H9F3N2 — CID 175877978

IUPAC6-[6-(trifluoromethyl)-3-pyridinyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3ncccc3c2)cn1
InChIInChI=1S/C15H9F3N2/c16-15(17,18)14-6-4-12(9-20-14)10-3-5-13-11(8-10)2-1-7-19-13/h1-9H
InChIKeyBWQYRPWETBCGLA-UHFFFAOYSA-N
MW274.25 g/mol
LogP4.32
Rot. Bonds1

About 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline

6-[6-(trifluoromethyl)-3-pyridinyl]quinoline (PubChem CID 175877978) has the molecular formula C15H9F3N2 and a molecular weight of 274.25 g/mol. Its IUPAC name is 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline.

Molecular Properties

Compound Name6-[6-(trifluoromethyl)-3-pyridinyl]quinoline
PubChem CID175877978
Molecular FormulaC15H9F3N2
Molecular Weight274.25 g/mol
Exact Mass274.07
IUPAC Name6-[6-(trifluoromethyl)-3-pyridinyl]quinoline
SMILESFC(F)(F)c1ccc(-c2ccc3ncccc3c2)cn1
InChIInChI=1S/C15H9F3N2/c16-15(17,18)14-6-4-12(9-20-14)10-3-5-13-11(8-10)2-1-7-19-13/h1-9H
InChIKeyBWQYRPWETBCGLA-UHFFFAOYSA-N
XLogP4.32
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline?
The IUPAC name of 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline (CID 175877978) is 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline.
What is the SMILES notation for 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline?
The canonical SMILES for 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline is FC(F)(F)c1ccc(-c2ccc3ncccc3c2)cn1.
What is the InChIKey of 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline?
The InChIKey is BWQYRPWETBCGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N2/c16-15(17,18)14-6-4-12(9-20-14)10-3-5-13-11(8-10)2-1-7-19-13/h1-9H.
What are the key properties of 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline?
6-[6-(trifluoromethyl)-3-pyridinyl]quinoline has a molecular weight of 274.25 g/mol, XLogP of 4.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(trifluoromethyl)-3-pyridinyl]quinoline is sourced from PubChem (CID 175877978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).