2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile

C18H15N3O2 — CID 82060873

IUPAC2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
SMILESCCOc1ccccc1-c1nc2ccc(C#N)c(C)n2c1C=O
InChIInChI=1S/C18H15N3O2/c1-3-23-16-7-5-4-6-14(16)18-15(11-22)21-12(2)13(10-19)8-9-17(21)20-18/h4-9,11H,3H2,1-2H3
InChIKeySVBQPJRQEQTXSH-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.39
Rot. Bonds4

About 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile

2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile (PubChem CID 82060873) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
PubChem CID82060873
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
SMILESCCOc1ccccc1-c1nc2ccc(C#N)c(C)n2c1C=O
InChIInChI=1S/C18H15N3O2/c1-3-23-16-7-5-4-6-14(16)18-15(11-22)21-12(2)13(10-19)8-9-17(21)20-18/h4-9,11H,3H2,1-2H3
InChIKeySVBQPJRQEQTXSH-UHFFFAOYSA-N
XLogP3.39
TPSA67.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
CID 82060848
3-formyl-2-(4-methoxyphenyl)-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
CID 82060867
6-bromo-2-(2-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 79041346
6-(2-ethoxyphenyl)-3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198900
6-(2-ethoxyphenyl)-2-hydrazinylpyridine-3-carbonitrile
CID 62252468
2-cyclohexyl-6-(2-ethoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole-5-carbaldehyde
CID 39198012
3-(2-ethoxyphenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198776
4-ethoxy-3-methylazulene-1-carbonitrile
CID 14615784
1-butyl-6-(2-ethoxyphenyl)-2-oxopyridine-3-carbonitrile
CID 82518797
4-(2-ethoxyphenyl)-2-methyl-1,3-thiazol-5-amine
CID 62082547
6-(2-ethoxyphenyl)pyridine-2-carbonitrile
CID 173380951
1-[2-(2-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029405

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile?
The IUPAC name of 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile (CID 82060873) is 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile.
What is the SMILES notation for 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile?
The canonical SMILES for 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile is CCOc1ccccc1-c1nc2ccc(C#N)c(C)n2c1C=O.
What is the InChIKey of 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile?
The InChIKey is SVBQPJRQEQTXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-3-23-16-7-5-4-6-14(16)18-15(11-22)21-12(2)13(10-19)8-9-17(21)20-18/h4-9,11H,3H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile?
2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile has a molecular weight of 305.34 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-3-formyl-5-methylimidazo[1,2-a]pyridine-6-carbonitrile is sourced from PubChem (CID 82060873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).