5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid

C15H13N3O4 — CID 71284093

IUPAC5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2cn3ccccc3n2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C15H13N3O4/c1-2-8-12(17-14(20)11(13(8)19)15(21)22)9-7-18-6-4-3-5-10(18)16-9/h3-7H,2H2,1H3,(H,21,22)(H2,17,19,20)
InChIKeyVIKLDNOCLZYINY-UHFFFAOYSA-N
MW299.29 g/mol
LogP1.66
Rot. Bonds3

About 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid

5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 71284093) has the molecular formula C15H13N3O4 and a molecular weight of 299.29 g/mol. Its IUPAC name is 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID71284093
Molecular FormulaC15H13N3O4
Molecular Weight299.29 g/mol
Exact Mass299.09
IUPAC Name5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCCc1c(-c2cn3ccccc3n2)[nH]c(=O)c(C(=O)O)c1O
InChIInChI=1S/C15H13N3O4/c1-2-8-12(17-14(20)11(13(8)19)15(21)22)9-7-18-6-4-3-5-10(18)16-9/h3-7H,2H2,1H3,(H,21,22)(H2,17,19,20)
InChIKeyVIKLDNOCLZYINY-UHFFFAOYSA-N
XLogP1.66
TPSA107.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.29
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid (CID 71284093) is 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid is CCc1c(-c2cn3ccccc3n2)[nH]c(=O)c(C(=O)O)c1O.
What is the InChIKey of 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is VIKLDNOCLZYINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O4/c1-2-8-12(17-14(20)11(13(8)19)15(21)22)9-7-18-6-4-3-5-10(18)16-9/h3-7H,2H2,1H3,(H,21,22)(H2,17,19,20).
What are the key properties of 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid?
5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 299.29 g/mol, XLogP of 1.66, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-hydroxy-6-imidazo[1,2-a]pyridin-2-yl-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 71284093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).