1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene

C22H22 — CID 123207081

IUPAC1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene
SMILESCc1ccccc1-c1ccc(C)c(-c2cccc(C)c2C)c1
InChIInChI=1S/C22H22/c1-15-9-7-11-21(18(15)4)22-14-19(13-12-17(22)3)20-10-6-5-8-16(20)2/h5-14H,1-4H3
InChIKeyGIIONWFRXYMAFO-UHFFFAOYSA-N
MW286.42 g/mol
LogP6.25
Rot. Bonds2

About 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene

1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene (PubChem CID 123207081) has the molecular formula C22H22 and a molecular weight of 286.42 g/mol. Its IUPAC name is 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene.

Molecular Properties

Compound Name1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene
PubChem CID123207081
Molecular FormulaC22H22
Molecular Weight286.42 g/mol
Exact Mass286.17
IUPAC Name1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene
SMILESCc1ccccc1-c1ccc(C)c(-c2cccc(C)c2C)c1
InChIInChI=1S/C22H22/c1-15-9-7-11-21(18(15)4)22-14-19(13-12-17(22)3)20-10-6-5-8-16(20)2/h5-14H,1-4H3
InChIKeyGIIONWFRXYMAFO-UHFFFAOYSA-N
XLogP6.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.42
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene with MolForge

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

Launch Full Analysis

Related Compounds

1-methyl-4-[2-methyl-3-(2-methylphenyl)phenyl]-2-(2-methylphenyl)benzene
CID 144952887
1,4-bis[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)benzene
CID 59609351
1-(3,4-dimethylphenyl)-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene
CID 143079541
1-methyl-2-(2-methylphenyl)-4-(3-phenylphenyl)benzene
CID 143578929
1,2-dimethyl-3-[2-(4-phenylphenyl)phenyl]benzene
CID 171799040
4-(2-methylphenyl)-1,2-diphenylbenzene
CID 59171693
azane;2-(2,3-dimethylphenyl)naphthalene
CID 175360237
1,2-dimethyl-3-(2-phenylphenyl)benzene
CID 54215466
ethane;1-methyl-2-(3-phenylphenyl)benzene
CID 142541189
ethane;1,3,5-tris(2-methylphenyl)benzene
CID 157145659
1-[4-(2,3-dimethylphenyl)phenyl]-2,4-dimethylbenzene
CID 144502475
2-[3-[4-methyl-3-(2-methylphenyl)phenyl]phenyl]triphenylene
CID 144803354

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene?
The IUPAC name of 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene (CID 123207081) is 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene.
What is the SMILES notation for 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene?
The canonical SMILES for 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene is Cc1ccccc1-c1ccc(C)c(-c2cccc(C)c2C)c1.
What is the InChIKey of 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene?
The InChIKey is GIIONWFRXYMAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22/c1-15-9-7-11-21(18(15)4)22-14-19(13-12-17(22)3)20-10-6-5-8-16(20)2/h5-14H,1-4H3.
What are the key properties of 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene?
1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene has a molecular weight of 286.42 g/mol, XLogP of 6.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-[2-methyl-5-(2-methylphenyl)phenyl]benzene is sourced from PubChem (CID 123207081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).