2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid

C11H6ClF3N2O3 — CID 143763062

IUPAC2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCC(=O)c1nc2c(C(F)(F)F)cc(C(=O)O)cn2c1Cl
InChIInChI=1S/C11H6ClF3N2O3/c1-4(18)7-8(12)17-3-5(10(19)20)2-6(9(17)16-7)11(13,14)15/h2-3H,1H3,(H,19,20)
InChIKeyZMCOBNQLCVBKFR-UHFFFAOYSA-N
MW306.63 g/mol
LogP2.91
Rot. Bonds2

About 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid

2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 143763062) has the molecular formula C11H6ClF3N2O3 and a molecular weight of 306.63 g/mol. Its IUPAC name is 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID143763062
Molecular FormulaC11H6ClF3N2O3
Molecular Weight306.63 g/mol
Exact Mass306.00
IUPAC Name2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESCC(=O)c1nc2c(C(F)(F)F)cc(C(=O)O)cn2c1Cl
InChIInChI=1S/C11H6ClF3N2O3/c1-4(18)7-8(12)17-3-5(10(19)20)2-6(9(17)16-7)11(13,14)15/h2-3H,1H3,(H,19,20)
InChIKeyZMCOBNQLCVBKFR-UHFFFAOYSA-N
XLogP2.91
TPSA71.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.63
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-6-(1,2-oxazol-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 68745272
3,8-dichloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 151278989
methyl 3-chloro-6-ethynyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 86647033
3-chloro-6-(2,5-dihydrofuran-2-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 67085065
4-tert-butyl-1-[3-chloro-6-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-1,2,4-triazinan-3-one
CID 130355893
4-[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-1-cyclobutylpiperazin-2-one
CID 51354205
3-[[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]amino]azetidine-1-carboxylic acid
CID 140539148
[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanediol
CID 162587588
[3-chloro-6-hex-3-en-3-yl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone
CID 90739145
methyl 3-chloro-6-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazol-4-yl]-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 67085092
4-[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-1-(oxan-4-yl)piperazin-2-one
CID 67084931
1-[3-chloro-6-cyclopropyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-4-(2,2,2-trifluoroethyl)-1,2,4-triazinan-3-one
CID 130281683

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid (CID 143763062) is 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid is CC(=O)c1nc2c(C(F)(F)F)cc(C(=O)O)cn2c1Cl.
What is the InChIKey of 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is ZMCOBNQLCVBKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF3N2O3/c1-4(18)7-8(12)17-3-5(10(19)20)2-6(9(17)16-7)11(13,14)15/h2-3H,1H3,(H,19,20).
What are the key properties of 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 306.63 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 143763062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).