2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine

C28H28N2 — CID 5256713

IUPAC2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
SMILESCc1cc(C)c(-c2cccc(-c3cccc(-c4c(C)cc(C)cc4C)n3)n2)c(C)c1
InChIInChI=1S/C28H28N2/c1-17-13-19(3)27(20(4)14-17)25-11-7-9-23(29-25)24-10-8-12-26(30-24)28-21(5)15-18(2)16-22(28)6/h7-16H,1-6H3
InChIKeyPXNPKFYAOLZUPO-UHFFFAOYSA-N
MW392.55 g/mol
LogP7.33
Rot. Bonds3

About 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine

2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine (PubChem CID 5256713) has the molecular formula C28H28N2 and a molecular weight of 392.55 g/mol. Its IUPAC name is 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
PubChem CID5256713
Molecular FormulaC28H28N2
Molecular Weight392.55 g/mol
Exact Mass392.23
IUPAC Name2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
SMILESCc1cc(C)c(-c2cccc(-c3cccc(-c4c(C)cc(C)cc4C)n3)n2)c(C)c1
InChIInChI=1S/C28H28N2/c1-17-13-19(3)27(20(4)14-17)25-11-7-9-23(29-25)24-10-8-12-26(30-24)28-21(5)15-18(2)16-22(28)6/h7-16H,1-6H3
InChIKeyPXNPKFYAOLZUPO-UHFFFAOYSA-N
XLogP7.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.55
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The IUPAC name of 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine (CID 5256713) is 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine.
What is the SMILES notation for 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The canonical SMILES for 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine is Cc1cc(C)c(-c2cccc(-c3cccc(-c4c(C)cc(C)cc4C)n3)n2)c(C)c1.
What is the InChIKey of 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The InChIKey is PXNPKFYAOLZUPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N2/c1-17-13-19(3)27(20(4)14-17)25-11-7-9-23(29-25)24-10-8-12-26(30-24)28-21(5)15-18(2)16-22(28)6/h7-16H,1-6H3.
What are the key properties of 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine has a molecular weight of 392.55 g/mol, XLogP of 7.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,6-trimethylphenyl)-6-[6-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 5256713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).