2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid

C17H15FN2O2 — CID 82060601

IUPAC2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid
SMILESCCc1ccc(-c2nc3ccc(F)cn3c2CC(=O)O)cc1
InChIInChI=1S/C17H15FN2O2/c1-2-11-3-5-12(6-4-11)17-14(9-16(21)22)20-10-13(18)7-8-15(20)19-17/h3-8,10H,2,9H2,1H3,(H,21,22)
InChIKeyBZJKAJCHSNTDPS-UHFFFAOYSA-N
MW298.32 g/mol
LogP3.33
Rot. Bonds4

About 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid

2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid (PubChem CID 82060601) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid
PubChem CID82060601
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid
SMILESCCc1ccc(-c2nc3ccc(F)cn3c2CC(=O)O)cc1
InChIInChI=1S/C17H15FN2O2/c1-2-11-3-5-12(6-4-11)17-14(9-16(21)22)20-10-13(18)7-8-15(20)19-17/h3-8,10H,2,9H2,1H3,(H,21,22)
InChIKeyBZJKAJCHSNTDPS-UHFFFAOYSA-N
XLogP3.33
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-fluoro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82060605
2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 82060679
2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid;hydrochloride
CID 74889750
ethane;2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 143742261
2-[2-(3,4-difluorophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide
CID 134152043
3-(chloromethyl)-6-fluoro-2-(4-fluorophenyl)imidazo[1,2-a]pyridine;hydrochloride
CID 67030270
2-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-1-methyliodanuidylethanone
CID 163800953
3-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]propanoic acid
CID 39195767
2-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82060205
N-(4-ethylphenyl)-3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 53036519
2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-1-pyrrolidin-1-ylethanone
CID 172677002
[6-chloro-2-(4-ethylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199144

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid?
The IUPAC name of 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid (CID 82060601) is 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid.
What is the SMILES notation for 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid?
The canonical SMILES for 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid is CCc1ccc(-c2nc3ccc(F)cn3c2CC(=O)O)cc1.
What is the InChIKey of 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid?
The InChIKey is BZJKAJCHSNTDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c1-2-11-3-5-12(6-4-11)17-14(9-16(21)22)20-10-13(18)7-8-15(20)19-17/h3-8,10H,2,9H2,1H3,(H,21,22).
What are the key properties of 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid?
2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid has a molecular weight of 298.32 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-ethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetic acid is sourced from PubChem (CID 82060601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).