4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine

C20H20N2 — CID 25185936

IUPAC4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine
SMILESCc1cc(-c2ccc(-c3cc(C)nc(C)c3)cc2)cc(C)n1
InChIInChI=1S/C20H20N2/c1-13-9-19(10-14(2)21-13)17-5-7-18(8-6-17)20-11-15(3)22-16(4)12-20/h5-12H,1-4H3
InChIKeyFLMQKAGQIXYIQI-UHFFFAOYSA-N
MW288.39 g/mol
LogP5.04
Rot. Bonds2

About 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine

4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine (PubChem CID 25185936) has the molecular formula C20H20N2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine
PubChem CID25185936
Molecular FormulaC20H20N2
Molecular Weight288.39 g/mol
Exact Mass288.16
IUPAC Name4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine
SMILESCc1cc(-c2ccc(-c3cc(C)nc(C)c3)cc2)cc(C)n1
InChIInChI=1S/C20H20N2/c1-13-9-19(10-14(2)21-13)17-5-7-18(8-6-17)20-11-15(3)22-16(4)12-20/h5-12H,1-4H3
InChIKeyFLMQKAGQIXYIQI-UHFFFAOYSA-N
XLogP5.04
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.39
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine?
The IUPAC name of 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine (CID 25185936) is 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine.
What is the SMILES notation for 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine?
The canonical SMILES for 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine is Cc1cc(-c2ccc(-c3cc(C)nc(C)c3)cc2)cc(C)n1.
What is the InChIKey of 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine?
The InChIKey is FLMQKAGQIXYIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2/c1-13-9-19(10-14(2)21-13)17-5-7-18(8-6-17)20-11-15(3)22-16(4)12-20/h5-12H,1-4H3.
What are the key properties of 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine?
4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine has a molecular weight of 288.39 g/mol, XLogP of 5.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-2,6-dimethylpyridine is sourced from PubChem (CID 25185936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).