2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine

C22H23NO5 — CID 90670579

IUPAC2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine
SMILESCOc1ccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1
InChIInChI=1S/C22H23NO5/c1-24-15-9-10-16(19(13-15)25-2)18-8-6-7-17(23-18)14-11-20(26-3)22(28-5)21(12-14)27-4/h6-13H,1-5H3
InChIKeyNOZZBEBNQRQPGG-UHFFFAOYSA-N
MW381.43 g/mol
LogP4.46
Rot. Bonds7

About 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine

2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine (PubChem CID 90670579) has the molecular formula C22H23NO5 and a molecular weight of 381.43 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine
PubChem CID90670579
Molecular FormulaC22H23NO5
Molecular Weight381.43 g/mol
Exact Mass381.16
IUPAC Name2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine
SMILESCOc1ccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1
InChIInChI=1S/C22H23NO5/c1-24-15-9-10-16(19(13-15)25-2)18-8-6-7-17(23-18)14-11-20(26-3)22(28-5)21(12-14)27-4/h6-13H,1-5H3
InChIKeyNOZZBEBNQRQPGG-UHFFFAOYSA-N
XLogP4.46
TPSA59.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Moxaverine
CID 70882
Octaverine
CID 68363
Dimoxyline
CID 21878
[6-(3-Hydroxy-4-methylphenyl)pyridin-2-yl](3,4,5-trimethoxyphenyl)methanone
CID 138857390
Galipine
CID 68235
2-(3',4'-Dimethoxyphenylethyl)quinoline
CID 11483233
Isoquinolinium, 1-((4-methoxyphenyl)methyl)-2-methyl-5,6,7-trimethoxy-, iodide
CID 199654
4-(3-Methoxy-5-methylphenoxy)-2-(4-methoxyphenyl)-6-methylpyridine
CID 71460891
4-(6,7-Dimethoxy-1-methylisoquinolin-3-YL)benzene-1,3-diol
CID 928685
3-(3,4-Dimethoxyphenyl)-1-ethyl-6,7-dimethoxyisoquinoline
CID 1119276
2-(3,4-Dimethoxyphenyl)quinoline
CID 2817404
6,7-Dimethoxy-3-(4-methoxyphenyl)-1-methylisoquinoline
CID 3717793

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine (CID 90670579) is 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine is COc1ccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine?
The InChIKey is NOZZBEBNQRQPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO5/c1-24-15-9-10-16(19(13-15)25-2)18-8-6-7-17(23-18)14-11-20(26-3)22(28-5)21(12-14)27-4/h6-13H,1-5H3.
What are the key properties of 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine?
2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine has a molecular weight of 381.43 g/mol, XLogP of 4.46, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine is sourced from PubChem (CID 90670579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).