3-methylimidazo[1,5-a]pyridine-6-carboxylic acid

C9H8N2O2 — CID 55264471

IUPAC3-methylimidazo[1,5-a]pyridine-6-carboxylic acid
SMILESCc1ncc2ccc(C(=O)O)cn12
InChIInChI=1S/C9H8N2O2/c1-6-10-4-8-3-2-7(9(12)13)5-11(6)8/h2-5H,1H3,(H,12,13)
InChIKeyKJQILHKNEOBPPU-UHFFFAOYSA-N
MW176.17 g/mol
LogP1.34
Rot. Bonds1

About 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid

3-methylimidazo[1,5-a]pyridine-6-carboxylic acid (PubChem CID 55264471) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name3-methylimidazo[1,5-a]pyridine-6-carboxylic acid
PubChem CID55264471
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name3-methylimidazo[1,5-a]pyridine-6-carboxylic acid
SMILESCc1ncc2ccc(C(=O)O)cn12
InChIInChI=1S/C9H8N2O2/c1-6-10-4-8-3-2-7(9(12)13)5-11(6)8/h2-5H,1H3,(H,12,13)
InChIKeyKJQILHKNEOBPPU-UHFFFAOYSA-N
XLogP1.34
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid?
The IUPAC name of 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid (CID 55264471) is 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid?
The canonical SMILES for 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid is Cc1ncc2ccc(C(=O)O)cn12.
What is the InChIKey of 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid?
The InChIKey is KJQILHKNEOBPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c1-6-10-4-8-3-2-7(9(12)13)5-11(6)8/h2-5H,1H3,(H,12,13).
What are the key properties of 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid?
3-methylimidazo[1,5-a]pyridine-6-carboxylic acid has a molecular weight of 176.17 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylimidazo[1,5-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 55264471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).