2-(trifluoromethyl)quinoline

C10H6F3N — CID 2777805

IUPAC2-(trifluoromethyl)quinoline
SMILESFC(F)(F)c1ccc2ccccc2n1
InChIInChI=1S/C10H6F3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H
InChIKeyYZSRICFIQLVSMQ-UHFFFAOYSA-N
MW197.16 g/mol
LogP3.25
Rot. Bonds

About 2-(trifluoromethyl)quinoline

2-(trifluoromethyl)quinoline (PubChem CID 2777805) has the molecular formula C10H6F3N and a molecular weight of 197.16 g/mol. Its IUPAC name is 2-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name2-(trifluoromethyl)quinoline
PubChem CID2777805
Molecular FormulaC10H6F3N
Molecular Weight197.16 g/mol
Exact Mass197.05
IUPAC Name2-(trifluoromethyl)quinoline
SMILESFC(F)(F)c1ccc2ccccc2n1
InChIInChI=1S/C10H6F3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H
InChIKeyYZSRICFIQLVSMQ-UHFFFAOYSA-N
XLogP3.25
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.16
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)quinoline?
The IUPAC name of 2-(trifluoromethyl)quinoline (CID 2777805) is 2-(trifluoromethyl)quinoline.
What is the SMILES notation for 2-(trifluoromethyl)quinoline?
The canonical SMILES for 2-(trifluoromethyl)quinoline is FC(F)(F)c1ccc2ccccc2n1.
What is the InChIKey of 2-(trifluoromethyl)quinoline?
The InChIKey is YZSRICFIQLVSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H.
What are the key properties of 2-(trifluoromethyl)quinoline?
2-(trifluoromethyl)quinoline has a molecular weight of 197.16 g/mol, XLogP of 3.25, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)quinoline is sourced from PubChem (CID 2777805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).