7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

C14H14N2O4 — CID 137005498

About 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid

7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 137005498) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

• Compound Name: 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
• PubChem CID: 137005498
• Molecular Formula: C14H14N2O4
• Molecular Weight: 274.28 g/mol
• Exact Mass: 274.10
• IUPAC Name: 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
• SMILES: O=C(O)c1nc(-c2ccccc2O)n2c1CC(O)CC2
• InChI: InChI=1S/C14H14N2O4/c17-8-5-6-16-10(7-8)12(14(19)20)15-13(16)9-3-1-2-4-11(9)18/h1-4,8,17-18H,5-7H2,(H,19,20)
• InChIKey: AEYYDAFMOWBLML-UHFFFAOYSA-N
• XLogP: 1.26
• TPSA: 95.58 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	274.28
LogP ≤ 5	1.26
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?

The IUPAC name of 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid (CID 137005498) is 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid.

What is the SMILES notation for 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?

The canonical SMILES for 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is O=C(O)c1nc(-c2ccccc2O)n2c1CC(O)CC2.

What is the InChIKey of 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?

The InChIKey is AEYYDAFMOWBLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c17-8-5-6-16-10(7-8)12(14(19)20)15-13(16)9-3-1-2-4-11(9)18/h1-4,8,17-18H,5-7H2,(H,19,20).

What are the key properties of 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid?

7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 274.28 g/mol, XLogP of 1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 137005498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).