2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine

C21H19N — CID 102107800

IUPAC2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine
SMILESCc1ccc(/C=C/c2ccccc2C)c(-c2ccccn2)c1
InChIInChI=1S/C21H19N/c1-16-10-11-19(13-12-18-8-4-3-7-17(18)2)20(15-16)21-9-5-6-14-22-21/h3-15H,1-2H3/b13-12+
InChIKeyVZVREIONCYKXQR-OUKQBFOZSA-N
MW285.39 g/mol
LogP5.54
Rot. Bonds3

About 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine

2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine (PubChem CID 102107800) has the molecular formula C21H19N and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine.

Molecular Properties

Compound Name2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine
PubChem CID102107800
Molecular FormulaC21H19N
Molecular Weight285.39 g/mol
Exact Mass285.15
IUPAC Name2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine
SMILESCc1ccc(/C=C/c2ccccc2C)c(-c2ccccn2)c1
InChIInChI=1S/C21H19N/c1-16-10-11-19(13-12-18-8-4-3-7-17(18)2)20(15-16)21-9-5-6-14-22-21/h3-15H,1-2H3/b13-12+
InChIKeyVZVREIONCYKXQR-OUKQBFOZSA-N
XLogP5.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.39
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 90050951
2-[5-(4-methylphenyl)-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 118204402
2-[2-[2-(2-pyridin-2-ylphenyl)ethenyl]phenyl]pyridine
CID 154584408
2-(2,4-dimethylphenyl)pyridine;ethane
CID 143636710
2-[2-[(E)-2-(2-methylphenyl)ethenyl]-4-(trifluoromethyl)phenyl]pyridine
CID 102107805
2-[4-methyl-2-[(E)-2-phenylethenyl]phenyl]pyridine
CID 132600270
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677
2-(2-methylphenyl)pyridine
CID 144596153
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
2-(2-iodo-5-methyl-3-pyridin-2-ylphenyl)pyridine
CID 101459024
2-[5-methyl-2-(4-methylphenyl)sulfonylphenyl]pyridine
CID 135001779
4-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenol
CID 68737342

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine?
The IUPAC name of 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine (CID 102107800) is 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine.
What is the SMILES notation for 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine?
The canonical SMILES for 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine is Cc1ccc(/C=C/c2ccccc2C)c(-c2ccccn2)c1.
What is the InChIKey of 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine?
The InChIKey is VZVREIONCYKXQR-OUKQBFOZSA-N. The full InChI is InChI=1S/C21H19N/c1-16-10-11-19(13-12-18-8-4-3-7-17(18)2)20(15-16)21-9-5-6-14-22-21/h3-15H,1-2H3/b13-12+.
What are the key properties of 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine?
2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine has a molecular weight of 285.39 g/mol, XLogP of 5.54, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]phenyl]pyridine is sourced from PubChem (CID 102107800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).