2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine

C20H19NO3 — CID 90670576

IUPAC2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine
SMILESCOc1ccc(-c2cccc(-c3ccc(OC)c(OC)c3)n2)cc1
InChIInChI=1S/C20H19NO3/c1-22-16-10-7-14(8-11-16)17-5-4-6-18(21-17)15-9-12-19(23-2)20(13-15)24-3/h4-13H,1-3H3
InChIKeyKNNKUAZPILMXKD-UHFFFAOYSA-N
MW321.38 g/mol
LogP4.44
Rot. Bonds5

About 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine

2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine (PubChem CID 90670576) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine
PubChem CID90670576
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Name2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine
SMILESCOc1ccc(-c2cccc(-c3ccc(OC)c(OC)c3)n2)cc1
InChIInChI=1S/C20H19NO3/c1-22-16-10-7-14(8-11-16)17-5-4-6-18(21-17)15-9-12-19(23-2)20(13-15)24-3/h4-13H,1-3H3
InChIKeyKNNKUAZPILMXKD-UHFFFAOYSA-N
XLogP4.44
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine (CID 90670576) is 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine is COc1ccc(-c2cccc(-c3ccc(OC)c(OC)c3)n2)cc1.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine?
The InChIKey is KNNKUAZPILMXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3/c1-22-16-10-7-14(8-11-16)17-5-4-6-18(21-17)15-9-12-19(23-2)20(13-15)24-3/h4-13H,1-3H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine?
2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine has a molecular weight of 321.38 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-6-(4-methoxyphenyl)pyridine is sourced from PubChem (CID 90670576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).