1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene

C18H22 — CID 14267704

IUPAC1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene
SMILESCc1ccccc1C(c1ccccc1C)C(C)C
InChIInChI=1S/C18H22/c1-13(2)18(16-11-7-5-9-14(16)3)17-12-8-6-10-15(17)4/h5-13,18H,1-4H3
InChIKeyCKGQVQHCJCDURD-UHFFFAOYSA-N
MW238.37 g/mol
LogP5.09
Rot. Bonds3

About 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene

1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene (PubChem CID 14267704) has the molecular formula C18H22 and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene.

Molecular Properties

Compound Name1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene
PubChem CID14267704
Molecular FormulaC18H22
Molecular Weight238.37 g/mol
Exact Mass238.17
IUPAC Name1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene
SMILESCc1ccccc1C(c1ccccc1C)C(C)C
InChIInChI=1S/C18H22/c1-13(2)18(16-11-7-5-9-14(16)3)17-12-8-6-10-15(17)4/h5-13,18H,1-4H3
InChIKeyCKGQVQHCJCDURD-UHFFFAOYSA-N
XLogP5.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.37
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-4,5-difluoro-2-[(1R)-2-methyl-1-(2-methylphenyl)propyl]benzene
CID 170063284
1-(1-chloro-2-methylpropyl)-2-methylbenzene
CID 67877325
(2S)-3-methyl-2-(2-methylphenyl)butanenitrile
CID 92978892
bis((1S)-1-(2-methylphenyl)ethanamine);dihydrochloride
CID 134129357
1-methyl-2-(2-methyl-1-propan-2-yloxypropyl)benzene
CID 158625827
1-[1-[2,3-dimethyl-1-(2-methylphenyl)butoxy]-2,3-dimethylbutyl]-2-methylbenzene
CID 169096953
bis(1-methyl-2-propan-2-ylbenzene);toluene
CID 162261210
CID 174622324
CID 174622324
(1S,2R)-1-amino-3-methyl-1-(2-methylphenyl)butan-2-ol
CID 130701027
O-[1-(2-methylphenyl)ethyl]hydroxylamine
CID 117104896
1-(2-methyl-1-naphthalen-1-ylpropyl)naphthalene
CID 174755343
CID 19362082
CID 19362082

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene?
The IUPAC name of 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene (CID 14267704) is 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene.
What is the SMILES notation for 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene?
The canonical SMILES for 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene is Cc1ccccc1C(c1ccccc1C)C(C)C.
What is the InChIKey of 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene?
The InChIKey is CKGQVQHCJCDURD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22/c1-13(2)18(16-11-7-5-9-14(16)3)17-12-8-6-10-15(17)4/h5-13,18H,1-4H3.
What are the key properties of 1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene?
1-methyl-2-[2-methyl-1-(2-methylphenyl)propyl]benzene has a molecular weight of 238.37 g/mol, XLogP of 5.09, 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-methyl-1-(2-methylphenyl)propyl]benzene is sourced from PubChem (CID 14267704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).