8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid

C13H7F3N2O2 — CID 14067488

IUPAC8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid
SMILESO=C(O)c1cn2c(ccc3ccc(C(F)(F)F)cc32)n1
InChIInChI=1S/C13H7F3N2O2/c14-13(15,16)8-3-1-7-2-4-11-17-9(12(19)20)6-18(11)10(7)5-8/h1-6H,(H,19,20)
InChIKeyUTPMLGAINJAXSX-UHFFFAOYSA-N
MW280.21 g/mol
LogP3.20
Rot. Bonds1

About 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid

8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid (PubChem CID 14067488) has the molecular formula C13H7F3N2O2 and a molecular weight of 280.21 g/mol. Its IUPAC name is 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid.

Molecular Properties

Compound Name8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid
PubChem CID14067488
Molecular FormulaC13H7F3N2O2
Molecular Weight280.21 g/mol
Exact Mass280.05
IUPAC Name8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid
SMILESO=C(O)c1cn2c(ccc3ccc(C(F)(F)F)cc32)n1
InChIInChI=1S/C13H7F3N2O2/c14-13(15,16)8-3-1-7-2-4-11-17-9(12(19)20)6-18(11)10(7)5-8/h1-6H,(H,19,20)
InChIKeyUTPMLGAINJAXSX-UHFFFAOYSA-N
XLogP3.20
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.21
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-fluoroimidazo[1,2-a]quinoline-2-carboxylic acid
CID 115037584
3-propan-2-yl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 82063206
(5-methylimidazo[1,2-a]pyridin-2-yl)-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 55582024
2-[6-(trifluoromethyl)indol-1-yl]propanoic acid
CID 123394835
6-(3,5-difluorophenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 83558087
6-[6-carboxy-4-(trifluoromethyl)-2-pyridinyl]-4-(trifluoromethyl)pyridine-2-carboxylic acid
CID 102113105
6-fluoro-5-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 133089695
1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol
CID 138663722
[1-ethyl-6-(trifluoromethyl)benzimidazol-2-yl]-methylcarbamic acid
CID 68886779
1-[2-methyl-5-(trifluoromethyl)phenyl]triazole-4-carboxylic acid
CID 66475268
4-oxo-7-(trifluoromethyl)pyrido[1,2-a]pyrimidine-3-carboxylic acid
CID 115048142
1,5,10-triazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraene-11-carboxylic acid
CID 175927555

Frequently Asked Questions

What is the IUPAC name of 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid?
The IUPAC name of 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid (CID 14067488) is 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid.
What is the SMILES notation for 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid?
The canonical SMILES for 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid is O=C(O)c1cn2c(ccc3ccc(C(F)(F)F)cc32)n1.
What is the InChIKey of 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid?
The InChIKey is UTPMLGAINJAXSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F3N2O2/c14-13(15,16)8-3-1-7-2-4-11-17-9(12(19)20)6-18(11)10(7)5-8/h1-6H,(H,19,20).
What are the key properties of 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid?
8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid has a molecular weight of 280.21 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid is sourced from PubChem (CID 14067488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).