5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid

C14H12N2O4 — CID 12763965

IUPAC5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid
SMILESCOc1ccc2c(OC)cc3nc(C(=O)O)cn3c2c1
InChIInChI=1S/C14H12N2O4/c1-19-8-3-4-9-11(5-8)16-7-10(14(17)18)15-13(16)6-12(9)20-2/h3-7H,1-2H3,(H,17,18)
InChIKeyWWQAPPGTHZRBMI-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.20
Rot. Bonds3

About 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid

5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid (PubChem CID 12763965) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid.

Molecular Properties

Compound Name5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid
PubChem CID12763965
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid
SMILESCOc1ccc2c(OC)cc3nc(C(=O)O)cn3c2c1
InChIInChI=1S/C14H12N2O4/c1-19-8-3-4-9-11(5-8)16-7-10(14(17)18)15-13(16)6-12(9)20-2/h3-7H,1-2H3,(H,17,18)
InChIKeyWWQAPPGTHZRBMI-UHFFFAOYSA-N
XLogP2.20
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid?
The IUPAC name of 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid (CID 12763965) is 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid.
What is the SMILES notation for 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid?
The canonical SMILES for 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid is COc1ccc2c(OC)cc3nc(C(=O)O)cn3c2c1.
What is the InChIKey of 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid?
The InChIKey is WWQAPPGTHZRBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c1-19-8-3-4-9-11(5-8)16-7-10(14(17)18)15-13(16)6-12(9)20-2/h3-7H,1-2H3,(H,17,18).
What are the key properties of 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid?
5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid has a molecular weight of 272.26 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethoxyimidazo[1,2-a]quinoline-2-carboxylic acid is sourced from PubChem (CID 12763965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).