8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde

C8H3BrCl2N2O — CID 82530955

IUPAC8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(Cl)nc2c(Br)cc(Cl)cn12
InChIInChI=1S/C8H3BrCl2N2O/c9-5-1-4(10)2-13-6(3-14)7(11)12-8(5)13/h1-3H
InChIKeyAQSHBHXXCAZOOQ-UHFFFAOYSA-N
MW293.94 g/mol
LogP3.22
Rot. Bonds1

About 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde

8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 82530955) has the molecular formula C8H3BrCl2N2O and a molecular weight of 293.94 g/mol. Its IUPAC name is 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID82530955
Molecular FormulaC8H3BrCl2N2O
Molecular Weight293.94 g/mol
Exact Mass291.88
IUPAC Name8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(Cl)nc2c(Br)cc(Cl)cn12
InChIInChI=1S/C8H3BrCl2N2O/c9-5-1-4(10)2-13-6(3-14)7(11)12-8(5)13/h1-3H
InChIKeyAQSHBHXXCAZOOQ-UHFFFAOYSA-N
XLogP3.22
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.94
LogP ≤ 53.22
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 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde (CID 82530955) is 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1c(Cl)nc2c(Br)cc(Cl)cn12.
What is the InChIKey of 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is AQSHBHXXCAZOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3BrCl2N2O/c9-5-1-4(10)2-13-6(3-14)7(11)12-8(5)13/h1-3H.
What are the key properties of 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde?
8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 293.94 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 82530955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).