6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid

C16H14N2O4 — CID 42878553

IUPAC6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCOc1ccc(OC)c(-c2ccc3nc(C(=O)O)cn3c2)c1
InChIInChI=1S/C16H14N2O4/c1-21-11-4-5-14(22-2)12(7-11)10-3-6-15-17-13(16(19)20)9-18(15)8-10/h3-9H,1-2H3,(H,19,20)
InChIKeyCSOWPTVXKMLLGJ-UHFFFAOYSA-N
MW298.30 g/mol
LogP2.72
Rot. Bonds4

About 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid

6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 42878553) has the molecular formula C16H14N2O4 and a molecular weight of 298.30 g/mol. Its IUPAC name is 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID42878553
Molecular FormulaC16H14N2O4
Molecular Weight298.30 g/mol
Exact Mass298.10
IUPAC Name6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCOc1ccc(OC)c(-c2ccc3nc(C(=O)O)cn3c2)c1
InChIInChI=1S/C16H14N2O4/c1-21-11-4-5-14(22-2)12(7-11)10-3-6-15-17-13(16(19)20)9-18(15)8-10/h3-9H,1-2H3,(H,19,20)
InChIKeyCSOWPTVXKMLLGJ-UHFFFAOYSA-N
XLogP2.72
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.30
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 42878543
5-(2,5-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53211472
3-(2,5-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 3571662
6-(5-fluoro-2-methoxyphenyl)-N-(2-phenylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690144
2-[4-(2,5-dimethoxyphenyl)phenyl]-1,4-dimethoxybenzene
CID 172792841
6-(3,5-difluorophenyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 83558087
[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-[6-(5-fluoro-2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]methanone
CID 42876567
2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 82357020
6-methoxycarbonylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 83837508
6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 68615554
N-(4-chlorophenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690070
2-[4-(2,5-dimethoxyphenyl)pyrazol-1-yl]acetic acid
CID 82121885

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid (CID 42878553) is 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid is COc1ccc(OC)c(-c2ccc3nc(C(=O)O)cn3c2)c1.
What is the InChIKey of 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is CSOWPTVXKMLLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O4/c1-21-11-4-5-14(22-2)12(7-11)10-3-6-15-17-13(16(19)20)9-18(15)8-10/h3-9H,1-2H3,(H,19,20).
What are the key properties of 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid?
6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 298.30 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 42878553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).