2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid

C18H17FN2O3 — CID 150733338

IUPAC2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid
SMILESCCC(C(=O)O)c1c(-c2ccc(F)cc2)nc2cc(OC)ccn12
InChIInChI=1S/C18H17FN2O3/c1-3-14(18(22)23)17-16(11-4-6-12(19)7-5-11)20-15-10-13(24-2)8-9-21(15)17/h4-10,14H,3H2,1-2H3,(H,22,23)
InChIKeyJSHLWUFWYAEYKC-UHFFFAOYSA-N
MW328.34 g/mol
LogP3.73
Rot. Bonds5

About 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid

2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid (PubChem CID 150733338) has the molecular formula C18H17FN2O3 and a molecular weight of 328.34 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid
PubChem CID150733338
Molecular FormulaC18H17FN2O3
Molecular Weight328.34 g/mol
Exact Mass328.12
IUPAC Name2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid
SMILESCCC(C(=O)O)c1c(-c2ccc(F)cc2)nc2cc(OC)ccn12
InChIInChI=1S/C18H17FN2O3/c1-3-14(18(22)23)17-16(11-4-6-12(19)7-5-11)20-15-10-13(24-2)8-9-21(15)17/h4-10,14H,3H2,1-2H3,(H,22,23)
InChIKeyJSHLWUFWYAEYKC-UHFFFAOYSA-N
XLogP3.73
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Miroprofen
CID 68752
3-(8-Methyl-2-imidazo[1,2-a]pyridinyl)-1-benzopyran-2-one
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CID 830970
2-(8-methoxy-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylacetamide
CID 10546805
2-(6-Methoxy-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-acetamide
CID 10690208
3-(imidazo[1,2-a]pyridin-2-yl)-2H-chromen-2-one
CID 397075
2-[1-[(4-Methoxyphenyl)methyl]-2-methylpyrrolo[2,3-b]pyridin-3-yl]acetic acid
CID 11709353
2-[6-(3-Methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetic acid
CID 154659101
2-[6-(4-Methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetic acid
CID 155019861
GPR40 agonist 5
CID 156013404
3-[3-(4-methoxybenzyl)-3H-imidazo[4,5-b]pyridin-2-yl]propanoic acid
CID 3241296
[2-[7-Methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 3-cyclopentylpropanoate
CID 3270376

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid?
The IUPAC name of 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid (CID 150733338) is 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid.
What is the SMILES notation for 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid?
The canonical SMILES for 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid is CCC(C(=O)O)c1c(-c2ccc(F)cc2)nc2cc(OC)ccn12.
What is the InChIKey of 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid?
The InChIKey is JSHLWUFWYAEYKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O3/c1-3-14(18(22)23)17-16(11-4-6-12(19)7-5-11)20-15-10-13(24-2)8-9-21(15)17/h4-10,14H,3H2,1-2H3,(H,22,23).
What are the key properties of 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid?
2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid has a molecular weight of 328.34 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]butanoic acid is sourced from PubChem (CID 150733338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).