2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde

C17H16N2O — CID 83966611

IUPAC2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCc1ccc(-c2cn3cc(C=O)cc(C)c3n2)c(C)c1
InChIInChI=1S/C17H16N2O/c1-11-4-5-15(12(2)6-11)16-9-19-8-14(10-20)7-13(3)17(19)18-16/h4-10H,1-3H3
InChIKeyMXLPSRVYBKHHSE-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.74
Rot. Bonds2

About 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde

2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde (PubChem CID 83966611) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
PubChem CID83966611
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCc1ccc(-c2cn3cc(C=O)cc(C)c3n2)c(C)c1
InChIInChI=1S/C17H16N2O/c1-11-4-5-15(12(2)6-11)16-9-19-8-14(10-20)7-13(3)17(19)18-16/h4-10H,1-3H3
InChIKeyMXLPSRVYBKHHSE-UHFFFAOYSA-N
XLogP3.74
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.74
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 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The IUPAC name of 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde (CID 83966611) is 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The canonical SMILES for 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde is Cc1ccc(-c2cn3cc(C=O)cc(C)c3n2)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The InChIKey is MXLPSRVYBKHHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-11-4-5-15(12(2)6-11)16-9-19-8-14(10-20)7-13(3)17(19)18-16/h4-10H,1-3H3.
What are the key properties of 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde has a molecular weight of 264.33 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 83966611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).