3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde

C12H12N2O — CID 83831720

IUPAC3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1ccn2c(C3CCC3)ncc2c1
InChIInChI=1S/C12H12N2O/c15-8-9-4-5-14-11(6-9)7-13-12(14)10-2-1-3-10/h4-8,10H,1-3H2
InChIKeyFGFHDKHXUGSFNI-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.41
Rot. Bonds2

About 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde

3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde (PubChem CID 83831720) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde.

Molecular Properties

Compound Name3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde
PubChem CID83831720
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1ccn2c(C3CCC3)ncc2c1
InChIInChI=1S/C12H12N2O/c15-8-9-4-5-14-11(6-9)7-13-12(14)10-2-1-3-10/h4-8,10H,1-3H2
InChIKeyFGFHDKHXUGSFNI-UHFFFAOYSA-N
XLogP2.41
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.41
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 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde?
The IUPAC name of 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde (CID 83831720) is 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde.
What is the SMILES notation for 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde?
The canonical SMILES for 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde is O=Cc1ccn2c(C3CCC3)ncc2c1.
What is the InChIKey of 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde?
The InChIKey is FGFHDKHXUGSFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c15-8-9-4-5-14-11(6-9)7-13-12(14)10-2-1-3-10/h4-8,10H,1-3H2.
What are the key properties of 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde?
3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde has a molecular weight of 200.24 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde is sourced from PubChem (CID 83831720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).