1-methyl-2-[2-(3-methylphenyl)ethyl]benzene

C16H18 — CID 13419836

IUPAC1-methyl-2-[2-(3-methylphenyl)ethyl]benzene
SMILESCc1cccc(CCc2ccccc2C)c1
InChIInChI=1S/C16H18/c1-13-6-5-8-15(12-13)10-11-16-9-4-3-7-14(16)2/h3-9,12H,10-11H2,1-2H3
InChIKeyFWLLFUQYTQEDRV-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.09
Rot. Bonds3

About 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene

1-methyl-2-[2-(3-methylphenyl)ethyl]benzene (PubChem CID 13419836) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1-methyl-2-[2-(3-methylphenyl)ethyl]benzene
PubChem CID13419836
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Name1-methyl-2-[2-(3-methylphenyl)ethyl]benzene
SMILESCc1cccc(CCc2ccccc2C)c1
InChIInChI=1S/C16H18/c1-13-6-5-8-15(12-13)10-11-16-9-4-3-7-14(16)2/h3-9,12H,10-11H2,1-2H3
InChIKeyFWLLFUQYTQEDRV-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-dimethyl-1-[2-(3-methylphenyl)ethyl]benzene
CID 165145096
4-(2-methylphenyl)-1-(3-methylphenyl)butan-2-one
CID 55067851
1-[2-(3-methylphenyl)ethyl]-2-[(2-methylphenyl)methyl]hydrazine
CID 143948560
2-[2-(2-methylphenyl)ethyl]guanidine;2-[2-(3-methylphenyl)ethyl]guanidine;2-[2-(4-methylphenyl)ethyl]guanidine
CID 159713930
2,4-dimethyl-1-(2-phenylethyl)benzene;gold
CID 173364905
1-methyl-3-[8-(3-methylphenyl)octyl]benzene
CID 22920080
2-methyl-5-[2-(3-methylphenyl)ethyl]aniline
CID 143291717
2-(3-methylphenyl)ethanolate
CID 142208639
2-[2-[2-[2-(2,5-dimethylphenyl)ethyl]phenyl]ethyl]-1,4-dimethylbenzene
CID 132604430
4-[2-(2-methylphenyl)ethyl]pyridine
CID 54132329
1-butyl-3-methylbenzene;ethane;propane
CID 142068173
2-(3-methylphenyl)ethanamine;hydrochloride
CID 47003273

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene?
The IUPAC name of 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene (CID 13419836) is 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene.
What is the SMILES notation for 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene?
The canonical SMILES for 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene is Cc1cccc(CCc2ccccc2C)c1.
What is the InChIKey of 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene?
The InChIKey is FWLLFUQYTQEDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18/c1-13-6-5-8-15(12-13)10-11-16-9-4-3-7-14(16)2/h3-9,12H,10-11H2,1-2H3.
What are the key properties of 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene?
1-methyl-2-[2-(3-methylphenyl)ethyl]benzene has a molecular weight of 210.32 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-(3-methylphenyl)ethyl]benzene is sourced from PubChem (CID 13419836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).