3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid

C19H20N2O4 — CID 42879880

IUPAC3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
SMILESCOc1ccc(OC)c(C(CC(=O)O)c2cnc3cccc(C)n23)c1
InChIInChI=1S/C19H20N2O4/c1-12-5-4-6-18-20-11-16(21(12)18)14(10-19(22)23)15-9-13(24-2)7-8-17(15)25-3/h4-9,11,14H,10H2,1-3H3,(H,22,23)
InChIKeyJOWFSFAXXLGMQL-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.27
Rot. Bonds6

About 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid

3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid (PubChem CID 42879880) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid.

Molecular Properties

Compound Name3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
PubChem CID42879880
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid
SMILESCOc1ccc(OC)c(C(CC(=O)O)c2cnc3cccc(C)n23)c1
InChIInChI=1S/C19H20N2O4/c1-12-5-4-6-18-20-11-16(21(12)18)14(10-19(22)23)15-9-13(24-2)7-8-17(15)25-3/h4-9,11,14H,10H2,1-3H3,(H,22,23)
InChIKeyJOWFSFAXXLGMQL-UHFFFAOYSA-N
XLogP3.27
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(5-methylimidazo[1,2-a]pyridin-3-yl)-3-(3-methylphenyl)propanoic acid
CID 42879881
3-[2-methoxy-5-(3-methoxyphenyl)phenyl]-3-(5-methyl-1,3-thiazol-2-yl)propanoic acid
CID 118533540
3-cyano-3-(2,5-dimethoxyphenyl)propanoic acid
CID 82129347
3,4-diamino-4-(2,5-dimethoxyphenyl)butanoic acid
CID 116942774
4-(2,5-dimethoxyphenyl)-4-hydroxy-3-(methylamino)butanoic acid
CID 82348737
2-[2-amino-2-(2,5-dimethoxyphenyl)ethoxy]acetic acid
CID 61327016
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-2-phenylacetamide
CID 40553494
N-[1-(2,5-dimethoxyphenyl)ethyl]-3,3-diphenylpropanamide
CID 85019951
1-[2-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-2-oxoethyl]pyrazole-4-carboxylic acid
CID 29089861
3-(3-methoxyphenyl)-3-(2-methyl-1H-imidazol-5-yl)propanoic acid
CID 116834155
4-(2,5-dimethoxyphenyl)-4-hydroxybutanoic acid
CID 6493924
2-[1-(2,5-dimethoxyphenyl)ethoxy]acetic acid
CID 112514494

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The IUPAC name of 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid (CID 42879880) is 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid.
What is the SMILES notation for 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The canonical SMILES for 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid is COc1ccc(OC)c(C(CC(=O)O)c2cnc3cccc(C)n23)c1.
What is the InChIKey of 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
The InChIKey is JOWFSFAXXLGMQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-12-5-4-6-18-20-11-16(21(12)18)14(10-19(22)23)15-9-13(24-2)7-8-17(15)25-3/h4-9,11,14H,10H2,1-3H3,(H,22,23).
What are the key properties of 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid?
3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid has a molecular weight of 340.38 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxyphenyl)-3-(5-methylimidazo[1,2-a]pyridin-3-yl)propanoic acid is sourced from PubChem (CID 42879880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).