2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid

C10H8N2O3 — CID 82282708

IUPAC2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid
SMILESCc1nc(C(=O)C(=O)O)c2ccccn12
InChIInChI=1S/C10H8N2O3/c1-6-11-8(9(13)10(14)15)7-4-2-3-5-12(6)7/h2-5H,1H3,(H,14,15)
InChIKeyXCORODDWEWSUJM-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.91
Rot. Bonds2

About 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid

2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid (PubChem CID 82282708) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid.

Molecular Properties

Compound Name2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid
PubChem CID82282708
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid
SMILESCc1nc(C(=O)C(=O)O)c2ccccn12
InChIInChI=1S/C10H8N2O3/c1-6-11-8(9(13)10(14)15)7-4-2-3-5-12(6)7/h2-5H,1H3,(H,14,15)
InChIKeyXCORODDWEWSUJM-UHFFFAOYSA-N
XLogP0.91
TPSA71.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

1,3-dihydroisoindol-2-yl-(3-methylimidazo[1,5-a]pyridin-1-yl)methanone
CID 167853594
2-(3-methylimidazo[1,5-a]pyridin-1-yl)acetic acid
CID 28797826
2-methoxyethyl 3-methylimidazo[1,5-a]pyridine-1-carboxylate
CID 56795161
3-methyl-N-(2-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110649549
2-(3-methylimidazo[1,5-a]pyridin-1-yl)pyrimidine-5-carboxylic acid
CID 169159865
N-(2-methoxyethyl)-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110647551
3-methyl-N-(2-phenoxyphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 110651101
N-[(2-chlorophenyl)methyl]-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110648110
N-[(4-chlorophenyl)methyl]-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110648131
N-(3,4-difluorophenyl)-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110651441
3-methylsulfinylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 21280356
(3-methylimidazo[1,5-a]pyridin-1-yl)-[4-(3-methylphenyl)piperazin-1-yl]methanone
CID 110648923

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid?
The IUPAC name of 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid (CID 82282708) is 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid.
What is the SMILES notation for 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid?
The canonical SMILES for 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid is Cc1nc(C(=O)C(=O)O)c2ccccn12.
What is the InChIKey of 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid?
The InChIKey is XCORODDWEWSUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c1-6-11-8(9(13)10(14)15)7-4-2-3-5-12(6)7/h2-5H,1H3,(H,14,15).
What are the key properties of 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid?
2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid has a molecular weight of 204.19 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylimidazo[1,5-a]pyridin-1-yl)-2-oxoacetic acid is sourced from PubChem (CID 82282708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).