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

C16H14N2O2 — CID 83966615

IUPAC2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCOc1ccc(-c2cn3cc(C=O)cc(C)c3n2)cc1
InChIInChI=1S/C16H14N2O2/c1-11-7-12(10-19)8-18-9-15(17-16(11)18)13-3-5-14(20-2)6-4-13/h3-10H,1-2H3
InChIKeyUTNWKZVNPQCQTA-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.13
Rot. Bonds3

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

2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde (PubChem CID 83966615) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
PubChem CID83966615
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde
SMILESCOc1ccc(-c2cn3cc(C=O)cc(C)c3n2)cc1
InChIInChI=1S/C16H14N2O2/c1-11-7-12(10-19)8-18-9-15(17-16(11)18)13-3-5-14(20-2)6-4-13/h3-10H,1-2H3
InChIKeyUTNWKZVNPQCQTA-UHFFFAOYSA-N
XLogP3.13
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.13
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-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The IUPAC name of 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde (CID 83966615) is 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The canonical SMILES for 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde is COc1ccc(-c2cn3cc(C=O)cc(C)c3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
The InChIKey is UTNWKZVNPQCQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-11-7-12(10-19)8-18-9-15(17-16(11)18)13-3-5-14(20-2)6-4-13/h3-10H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde?
2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde has a molecular weight of 266.30 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-8-methylimidazo[1,2-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 83966615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).