2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde

C9H7ClN2O2 — CID 166925831

IUPAC2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde
SMILESO=CCOc1cn2ccnc2cc1Cl
InChIInChI=1S/C9H7ClN2O2/c10-7-5-9-11-1-2-12(9)6-8(7)14-4-3-13/h1-3,5-6H,4H2
InChIKeyQOQIVQLMNVFNGF-UHFFFAOYSA-N
MW210.62 g/mol
LogP1.57
Rot. Bonds3

About 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde

2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde (PubChem CID 166925831) has the molecular formula C9H7ClN2O2 and a molecular weight of 210.62 g/mol. Its IUPAC name is 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde.

Molecular Properties

Compound Name2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde
PubChem CID166925831
Molecular FormulaC9H7ClN2O2
Molecular Weight210.62 g/mol
Exact Mass210.02
IUPAC Name2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde
SMILESO=CCOc1cn2ccnc2cc1Cl
InChIInChI=1S/C9H7ClN2O2/c10-7-5-9-11-1-2-12(9)6-8(7)14-4-3-13/h1-3,5-6H,4H2
InChIKeyQOQIVQLMNVFNGF-UHFFFAOYSA-N
XLogP1.57
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.62
LogP ≤ 51.57
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 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde?
The IUPAC name of 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde (CID 166925831) is 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde.
What is the SMILES notation for 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde?
The canonical SMILES for 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde is O=CCOc1cn2ccnc2cc1Cl.
What is the InChIKey of 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde?
The InChIKey is QOQIVQLMNVFNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O2/c10-7-5-9-11-1-2-12(9)6-8(7)14-4-3-13/h1-3,5-6H,4H2.
What are the key properties of 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde?
2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde has a molecular weight of 210.62 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloroimidazo[1,2-a]pyridin-6-yl)oxyacetaldehyde is sourced from PubChem (CID 166925831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).