3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid

C17H16N2O2 — CID 79432572

IUPAC3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid
SMILESCc1ccccc1C(Cc1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C17H16N2O2/c1-12-6-2-3-7-14(12)15(17(20)21)10-13-11-19-9-5-4-8-16(19)18-13/h2-9,11,15H,10H2,1H3,(H,20,21)
InChIKeySGWZKDAJQHBDKY-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.05
Rot. Bonds4

About 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid

3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid (PubChem CID 79432572) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid.

Molecular Properties

Compound Name3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid
PubChem CID79432572
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid
SMILESCc1ccccc1C(Cc1cn2ccccc2n1)C(=O)O
InChIInChI=1S/C17H16N2O2/c1-12-6-2-3-7-14(12)15(17(20)21)10-13-11-19-9-5-4-8-16(19)18-13/h2-9,11,15H,10H2,1H3,(H,20,21)
InChIKeySGWZKDAJQHBDKY-UHFFFAOYSA-N
XLogP3.05
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-imidazo[2,1-b][1,3]thiazol-6-yl-2-(2-methylphenyl)propanoic acid
CID 115332537
2-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methoxy-3-oxopropanoic acid
CID 103973250
2-(2-methylphenyl)-3-(2-methyl-1,3-thiazol-4-yl)propanoic acid
CID 79421180
4-imidazo[1,2-a]pyridin-2-yl-3-methylbutan-2-ol
CID 79422982
3-imidazo[1,2-a]pyridin-2-yl-2-methyl-1-phenylpropan-1-ol
CID 104846255
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 43355303
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
3-imidazo[1,2-a]pyridin-2-yl-2-methylpropan-1-amine
CID 83877207
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]-3-methylbutanoic acid
CID 43353990
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
CID 43469348
3-hydroxy-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
CID 43353673
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzoic acid
CID 60698887

Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid?
The IUPAC name of 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid (CID 79432572) is 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid.
What is the SMILES notation for 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid?
The canonical SMILES for 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid is Cc1ccccc1C(Cc1cn2ccccc2n1)C(=O)O.
What is the InChIKey of 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid?
The InChIKey is SGWZKDAJQHBDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-12-6-2-3-7-14(12)15(17(20)21)10-13-11-19-9-5-4-8-16(19)18-13/h2-9,11,15H,10H2,1H3,(H,20,21).
What are the key properties of 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid?
3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid has a molecular weight of 280.33 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-a]pyridin-2-yl-2-(2-methylphenyl)propanoic acid is sourced from PubChem (CID 79432572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).