3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde

C10H8N2O2 — CID 11240902

IUPAC3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde
SMILESCC(=O)c1c(C=O)nc2ccccn12
InChIInChI=1S/C10H8N2O2/c1-7(14)10-8(6-13)11-9-4-2-3-5-12(9)10/h2-6H,1H3
InChIKeyVBICRYRKOUNRDW-UHFFFAOYSA-N
MW188.19 g/mol
LogP1.35
Rot. Bonds2

About 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde

3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde (PubChem CID 11240902) has the molecular formula C10H8N2O2 and a molecular weight of 188.19 g/mol. Its IUPAC name is 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde
PubChem CID11240902
Molecular FormulaC10H8N2O2
Molecular Weight188.19 g/mol
Exact Mass188.06
IUPAC Name3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde
SMILESCC(=O)c1c(C=O)nc2ccccn12
InChIInChI=1S/C10H8N2O2/c1-7(14)10-8(6-13)11-9-4-2-3-5-12(9)10/h2-6H,1H3
InChIKeyVBICRYRKOUNRDW-UHFFFAOYSA-N
XLogP1.35
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-acetylimidazo[1,2-a]pyridine-2-carbaldehyde?
The IUPAC name of 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde (CID 11240902) is 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde.
What is the SMILES notation for 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde?
The canonical SMILES for 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde is CC(=O)c1c(C=O)nc2ccccn12.
What is the InChIKey of 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde?
The InChIKey is VBICRYRKOUNRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2/c1-7(14)10-8(6-13)11-9-4-2-3-5-12(9)10/h2-6H,1H3.
What are the key properties of 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde?
3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde has a molecular weight of 188.19 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetylimidazo[1,2-a]pyridine-2-carbaldehyde is sourced from PubChem (CID 11240902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).