3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid

C15H10N2O4 — CID 117252473

IUPAC3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
SMILESO=C(O)c1cccn2c(-c3ccccc3)nc(C(=O)O)c12
InChIInChI=1S/C15H10N2O4/c18-14(19)10-7-4-8-17-12(10)11(15(20)21)16-13(17)9-5-2-1-3-6-9/h1-8H,(H,18,19)(H,20,21)
InChIKeyFWWOVSNYTXBLQN-UHFFFAOYSA-N
MW282.25 g/mol
LogP2.40
Rot. Bonds3

About 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid

3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid (PubChem CID 117252473) has the molecular formula C15H10N2O4 and a molecular weight of 282.25 g/mol. Its IUPAC name is 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid.

Molecular Properties

Compound Name3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
PubChem CID117252473
Molecular FormulaC15H10N2O4
Molecular Weight282.25 g/mol
Exact Mass282.06
IUPAC Name3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
SMILESO=C(O)c1cccn2c(-c3ccccc3)nc(C(=O)O)c12
InChIInChI=1S/C15H10N2O4/c18-14(19)10-7-4-8-17-12(10)11(15(20)21)16-13(17)9-5-2-1-3-6-9/h1-8H,(H,18,19)(H,20,21)
InChIKeyFWWOVSNYTXBLQN-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 ≤ 500282.25
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252602
3-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252544
3-ethylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252398
3-propylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252400
1-bromo-3-(3-methylphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 84609069
1-chloro-3-pyridin-3-ylimidazo[1,5-a]pyridine-8-carboxylic acid
CID 117252354
8-methyl-3-(2-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 84742896
3-methyl-2-phenylimidazo[1,2-a]pyridine-8-carboxylic acid;hydrochloride
CID 52983714
8-amino-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252626
1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117252470
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 28752075
3-(1-methylpyrrol-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 82477425

Frequently Asked Questions

What is the IUPAC name of 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid?
The IUPAC name of 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid (CID 117252473) is 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid.
What is the SMILES notation for 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid?
The canonical SMILES for 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid is O=C(O)c1cccn2c(-c3ccccc3)nc(C(=O)O)c12.
What is the InChIKey of 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid?
The InChIKey is FWWOVSNYTXBLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O4/c18-14(19)10-7-4-8-17-12(10)11(15(20)21)16-13(17)9-5-2-1-3-6-9/h1-8H,(H,18,19)(H,20,21).
What are the key properties of 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid?
3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid has a molecular weight of 282.25 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 3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid is sourced from PubChem (CID 117252473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).