4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde

C14H10N2O — CID 820963

IUPAC4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde
SMILESO=Cc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C14H10N2O/c17-10-11-4-6-12(7-5-11)13-9-16-8-2-1-3-14(16)15-13/h1-10H
InChIKeyMEDHSOWGQJBYSH-UHFFFAOYSA-N
MW222.25 g/mol
LogP2.81
Rot. Bonds2

About 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde

4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde (PubChem CID 820963) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde
PubChem CID820963
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde
SMILESO=Cc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C14H10N2O/c17-10-11-4-6-12(7-5-11)13-9-16-8-2-1-3-14(16)15-13/h1-10H
InChIKeyMEDHSOWGQJBYSH-UHFFFAOYSA-N
XLogP2.81
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.81
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 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde?
The IUPAC name of 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde (CID 820963) is 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde.
What is the SMILES notation for 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde?
The canonical SMILES for 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde is O=Cc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde?
The InChIKey is MEDHSOWGQJBYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c17-10-11-4-6-12(7-5-11)13-9-16-8-2-1-3-14(16)15-13/h1-10H.
What are the key properties of 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde?
4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde has a molecular weight of 222.25 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde is sourced from PubChem (CID 820963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).