2-methyl-1-phenyl-4-(2-phenylphenyl)benzene

C25H20 — CID 59171665

IUPAC2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
SMILESCc1cc(-c2ccccc2-c2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C25H20/c1-19-18-22(16-17-23(19)20-10-4-2-5-11-20)25-15-9-8-14-24(25)21-12-6-3-7-13-21/h2-18H,1H3
InChIKeySURPEWLBXPQGMB-UHFFFAOYSA-N
MW320.44 g/mol
LogP7.00
Rot. Bonds3

About 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene

2-methyl-1-phenyl-4-(2-phenylphenyl)benzene (PubChem CID 59171665) has the molecular formula C25H20 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene.

Molecular Properties

Compound Name2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
PubChem CID59171665
Molecular FormulaC25H20
Molecular Weight320.44 g/mol
Exact Mass320.16
IUPAC Name2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
SMILESCc1cc(-c2ccccc2-c2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C25H20/c1-19-18-22(16-17-23(19)20-10-4-2-5-11-20)25-15-9-8-14-24(25)21-12-6-3-7-13-21/h2-18H,1H3
InChIKeySURPEWLBXPQGMB-UHFFFAOYSA-N
XLogP7.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 57.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene?
The IUPAC name of 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene (CID 59171665) is 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene.
What is the SMILES notation for 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene?
The canonical SMILES for 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene is Cc1cc(-c2ccccc2-c2ccccc2)ccc1-c1ccccc1.
What is the InChIKey of 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene?
The InChIKey is SURPEWLBXPQGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20/c1-19-18-22(16-17-23(19)20-10-4-2-5-11-20)25-15-9-8-14-24(25)21-12-6-3-7-13-21/h2-18H,1H3.
What are the key properties of 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene?
2-methyl-1-phenyl-4-(2-phenylphenyl)benzene has a molecular weight of 320.44 g/mol, XLogP of 7.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-phenyl-4-(2-phenylphenyl)benzene is sourced from PubChem (CID 59171665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).