2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

C15H10N2O4 — CID 117128170

IUPAC2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1
InChIInChI=1S/C15H10N2O4/c18-14(19)10-3-1-9(2-4-10)12-8-17-7-11(15(20)21)5-6-13(17)16-12/h1-8H,(H,18,19)(H,20,21)
InChIKeyFJADZXCBGPCFJH-UHFFFAOYSA-N
MW282.26 g/mol
LogP2.40
Rot. Bonds3

About 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid

2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (PubChem CID 117128170) has the molecular formula C15H10N2O4 and a molecular weight of 282.26 g/mol. Its IUPAC name is 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
PubChem CID117128170
Molecular FormulaC15H10N2O4
Molecular Weight282.26 g/mol
Exact Mass282.06
IUPAC Name2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
SMILESO=C(O)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1
InChIInChI=1S/C15H10N2O4/c18-14(19)10-3-1-9(2-4-10)12-8-17-7-11(15(20)21)5-6-13(17)16-12/h1-8H,(H,18,19)(H,20,21)
InChIKeyFJADZXCBGPCFJH-UHFFFAOYSA-N
XLogP2.40
TPSA91.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The IUPAC name of 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid (CID 117128170) is 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The canonical SMILES for 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is O=C(O)c1ccc(-c2cn3cc(C(=O)O)ccc3n2)cc1.
What is the InChIKey of 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
The InChIKey is FJADZXCBGPCFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O4/c18-14(19)10-3-1-9(2-4-10)12-8-17-7-11(15(20)21)5-6-13(17)16-12/h1-8H,(H,18,19)(H,20,21).
What are the key properties of 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid?
2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid has a molecular weight of 282.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 117128170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).