2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid

C15H9F3N2O2 — CID 117135507

IUPAC2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2cc(-c3ccc(C(F)(F)F)cc3)nc2c1
InChIInChI=1S/C15H9F3N2O2/c16-15(17,18)11-3-1-9(2-4-11)12-8-20-6-5-10(14(21)22)7-13(20)19-12/h1-8H,(H,21,22)
InChIKeyARMFLXFPBMJTNE-UHFFFAOYSA-N
MW306.24 g/mol
LogP3.72
Rot. Bonds2

About 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid

2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid (PubChem CID 117135507) has the molecular formula C15H9F3N2O2 and a molecular weight of 306.24 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid
PubChem CID117135507
Molecular FormulaC15H9F3N2O2
Molecular Weight306.24 g/mol
Exact Mass306.06
IUPAC Name2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2cc(-c3ccc(C(F)(F)F)cc3)nc2c1
InChIInChI=1S/C15H9F3N2O2/c16-15(17,18)11-3-1-9(2-4-11)12-8-20-6-5-10(14(21)22)7-13(20)19-12/h1-8H,(H,21,22)
InChIKeyARMFLXFPBMJTNE-UHFFFAOYSA-N
XLogP3.72
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.24
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 9146654
2-(4-butan-2-ylphenyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 82357029
methyl 4-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzoate
CID 45158622
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108801367
2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-8-carboxylic acid
CID 117137722
4-[7-(methylamino)imidazo[1,2-a]pyridin-2-yl]benzoic acid
CID 141417395
imidazo[1,2-a]pyridine-2,7-dicarboxylic acid
CID 19701499
N-[2-methoxy-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 122322767
3-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid
CID 117145311
2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-6-ol
CID 117130812
2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117128170
N-methyl-1-[5-[2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-7-yl]-2H-triazol-4-yl]methanimine
CID 170147503

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid?
The IUPAC name of 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid (CID 117135507) is 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid?
The canonical SMILES for 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid is O=C(O)c1ccn2cc(-c3ccc(C(F)(F)F)cc3)nc2c1.
What is the InChIKey of 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid?
The InChIKey is ARMFLXFPBMJTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N2O2/c16-15(17,18)11-3-1-9(2-4-11)12-8-20-6-5-10(14(21)22)7-13(20)19-12/h1-8H,(H,21,22).
What are the key properties of 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid?
2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid has a molecular weight of 306.24 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 117135507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).