2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine

C24H21N3O3 — CID 101416106

IUPAC2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine
SMILESCOc1cc(OC)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(OC)c1
InChIInChI=1S/C24H21N3O3/c1-28-17-14-22(29-2)24(23(15-17)30-3)16-12-20(18-8-4-6-10-25-18)27-21(13-16)19-9-5-7-11-26-19/h4-15H,1-3H3
InChIKeyUSQBQFGWKLMAQK-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.90
Rot. Bonds6

About 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine

2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine (PubChem CID 101416106) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine.

Molecular Properties

Compound Name2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine
PubChem CID101416106
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC Name2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine
SMILESCOc1cc(OC)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(OC)c1
InChIInChI=1S/C24H21N3O3/c1-28-17-14-22(29-2)24(23(15-17)30-3)16-12-20(18-8-4-6-10-25-18)27-21(13-16)19-9-5-7-11-26-19/h4-15H,1-3H3
InChIKeyUSQBQFGWKLMAQK-UHFFFAOYSA-N
XLogP4.90
TPSA66.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine?
The IUPAC name of 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine (CID 101416106) is 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine.
What is the SMILES notation for 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine?
The canonical SMILES for 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine is COc1cc(OC)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(OC)c1.
What is the InChIKey of 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine?
The InChIKey is USQBQFGWKLMAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-28-17-14-22(29-2)24(23(15-17)30-3)16-12-20(18-8-4-6-10-25-18)27-21(13-16)19-9-5-7-11-26-19/h4-15H,1-3H3.
What are the key properties of 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine?
2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine has a molecular weight of 399.45 g/mol, XLogP of 4.90, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipyridin-2-yl-4-(2,4,6-trimethoxyphenyl)pyridine is sourced from PubChem (CID 101416106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).