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

C24H21N3 — CID 11783109

IUPAC2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine
SMILESCc1cc(C)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C)c1
InChIInChI=1S/C24H21N3/c1-16-12-17(2)24(18(3)13-16)19-14-22(20-8-4-6-10-25-20)27-23(15-19)21-9-5-7-11-26-21/h4-15H,1-3H3
InChIKeyCWCKLEFHGLGHMF-UHFFFAOYSA-N
MW351.45 g/mol
LogP5.80
Rot. Bonds3

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

2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine (PubChem CID 11783109) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine.

Molecular Properties

Compound Name2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine
PubChem CID11783109
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine
SMILESCc1cc(C)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C)c1
InChIInChI=1S/C24H21N3/c1-16-12-17(2)24(18(3)13-16)19-14-22(20-8-4-6-10-25-20)27-23(15-19)21-9-5-7-11-26-21/h4-15H,1-3H3
InChIKeyCWCKLEFHGLGHMF-UHFFFAOYSA-N
XLogP5.80
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine?
The IUPAC name of 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine (CID 11783109) is 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine.
What is the SMILES notation for 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine?
The canonical SMILES for 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine is Cc1cc(C)c(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C)c1.
What is the InChIKey of 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine?
The InChIKey is CWCKLEFHGLGHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-16-12-17(2)24(18(3)13-16)19-14-22(20-8-4-6-10-25-20)27-23(15-19)21-9-5-7-11-26-21/h4-15H,1-3H3.
What are the key properties of 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine?
2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine has a molecular weight of 351.45 g/mol, XLogP of 5.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipyridin-2-yl-4-(2,4,6-trimethylphenyl)pyridine is sourced from PubChem (CID 11783109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).