2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde

C12H12N2O — CID 83880672

IUPAC2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde
SMILESO=CCc1ccc2cnc(C3CC3)n2c1
InChIInChI=1S/C12H12N2O/c15-6-5-9-1-4-11-7-13-12(10-2-3-10)14(11)8-9/h1,4,6-8,10H,2-3,5H2
InChIKeyOIGIIRPIRURISQ-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.95
Rot. Bonds3

About 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde

2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde (PubChem CID 83880672) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde.

Molecular Properties

Compound Name2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde
PubChem CID83880672
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde
SMILESO=CCc1ccc2cnc(C3CC3)n2c1
InChIInChI=1S/C12H12N2O/c15-6-5-9-1-4-11-7-13-12(10-2-3-10)14(11)8-9/h1,4,6-8,10H,2-3,5H2
InChIKeyOIGIIRPIRURISQ-UHFFFAOYSA-N
XLogP1.95
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde?
The IUPAC name of 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde (CID 83880672) is 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde.
What is the SMILES notation for 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde?
The canonical SMILES for 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde is O=CCc1ccc2cnc(C3CC3)n2c1.
What is the InChIKey of 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde?
The InChIKey is OIGIIRPIRURISQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c15-6-5-9-1-4-11-7-13-12(10-2-3-10)14(11)8-9/h1,4,6-8,10H,2-3,5H2.
What are the key properties of 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde?
2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde has a molecular weight of 200.24 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)acetaldehyde is sourced from PubChem (CID 83880672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).