2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine

C21H19N — CID 144512518

IUPAC2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine
SMILESC=Cc1ccccc1-c1cc(CC)c(-c2ccccc2)cn1
InChIInChI=1S/C21H19N/c1-3-16-10-8-9-13-19(16)21-14-17(4-2)20(15-22-21)18-11-6-5-7-12-18/h3,5-15H,1,4H2,2H3
InChIKeyKUFUBEPELYUEMS-UHFFFAOYSA-N
MW285.39 g/mol
LogP5.62
Rot. Bonds4

About 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine

2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine (PubChem CID 144512518) has the molecular formula C21H19N and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine.

Molecular Properties

Compound Name2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine
PubChem CID144512518
Molecular FormulaC21H19N
Molecular Weight285.39 g/mol
Exact Mass285.15
IUPAC Name2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine
SMILESC=Cc1ccccc1-c1cc(CC)c(-c2ccccc2)cn1
InChIInChI=1S/C21H19N/c1-3-16-10-8-9-13-19(16)21-14-17(4-2)20(15-22-21)18-11-6-5-7-12-18/h3,5-15H,1,4H2,2H3
InChIKeyKUFUBEPELYUEMS-UHFFFAOYSA-N
XLogP5.62
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.39
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine?
The IUPAC name of 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine (CID 144512518) is 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine.
What is the SMILES notation for 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine?
The canonical SMILES for 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine is C=Cc1ccccc1-c1cc(CC)c(-c2ccccc2)cn1.
What is the InChIKey of 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine?
The InChIKey is KUFUBEPELYUEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N/c1-3-16-10-8-9-13-19(16)21-14-17(4-2)20(15-22-21)18-11-6-5-7-12-18/h3,5-15H,1,4H2,2H3.
What are the key properties of 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine?
2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine has a molecular weight of 285.39 g/mol, XLogP of 5.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenylphenyl)-4-ethyl-5-phenylpyridine is sourced from PubChem (CID 144512518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).