3-methylimidazo[1,5-a]pyridine-1-carbaldehyde

C9H8N2O — CID 1383643

IUPAC3-methylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCc1nc(C=O)c2ccccn12
InChIInChI=1S/C9H8N2O/c1-7-10-8(6-12)9-4-2-3-5-11(7)9/h2-6H,1H3
InChIKeyVBGXAPXLVGMZBR-UHFFFAOYSA-N
MW160.18 g/mol
LogP1.46
Rot. Bonds1

About 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde

3-methylimidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 1383643) has the molecular formula C9H8N2O and a molecular weight of 160.18 g/mol. Its IUPAC name is 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-methylimidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID1383643
Molecular FormulaC9H8N2O
Molecular Weight160.18 g/mol
Exact Mass160.06
IUPAC Name3-methylimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCc1nc(C=O)c2ccccn12
InChIInChI=1S/C9H8N2O/c1-7-10-8(6-12)9-4-2-3-5-11(7)9/h2-6H,1H3
InChIKeyVBGXAPXLVGMZBR-UHFFFAOYSA-N
XLogP1.46
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde (CID 1383643) is 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde is Cc1nc(C=O)c2ccccn12.
What is the InChIKey of 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is VBGXAPXLVGMZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O/c1-7-10-8(6-12)9-4-2-3-5-11(7)9/h2-6H,1H3.
What are the key properties of 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde?
3-methylimidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 160.18 g/mol, XLogP of 1.46, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylimidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 1383643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).