1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene

C17H20 — CID 143282666

IUPAC1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene
SMILESCc1ccc(CCc2c(C)cccc2C)cc1
InChIInChI=1S/C17H20/c1-13-7-9-16(10-8-13)11-12-17-14(2)5-4-6-15(17)3/h4-10H,11-12H2,1-3H3
InChIKeyRVSLRWHWKMUDNR-UHFFFAOYSA-N
MW224.35 g/mol
LogP4.40
Rot. Bonds3

About 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene

1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene (PubChem CID 143282666) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene
PubChem CID143282666
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene
SMILESCc1ccc(CCc2c(C)cccc2C)cc1
InChIInChI=1S/C17H20/c1-13-7-9-16(10-8-13)11-12-17-14(2)5-4-6-15(17)3/h4-10H,11-12H2,1-3H3
InChIKeyRVSLRWHWKMUDNR-UHFFFAOYSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-bis[2-(4-methylphenyl)ethyl]benzene;fluoromethane
CID 91266439
1-methyl-4-[2-[4-[4-(4-methylphenyl)butyl]phenyl]ethyl]benzene
CID 4174966
2-[5-(2,6-dimethylphenyl)pentyl]-1,3-dimethylbenzene
CID 22921267
1-methyl-3-(2-methylphenyl)-2-(2-phenylethyl)benzene
CID 173430520
methanamine;2-(4-methylphenyl)ethanamine
CID 144589082
1-fluoro-4-methylbenzene;1-fluoro-4-[2-(4-methylphenyl)ethyl]benzene
CID 144561335
1-iodo-4-[2-(4-methylphenyl)ethyl]benzene
CID 118487182
1-methyl-2-[5-(4-methylphenyl)pentyl]benzene
CID 173152052
1-methyl-4-[4-[2-(4-propylphenyl)ethyl]phenyl]benzene
CID 140875006
2-[2-[2-(2,6-dimethylphenyl)ethoxy]ethyl]-1,3-dimethylbenzene
CID 139601622
1-methyl-4-[2-[4-(4-methylphenoxy)phenyl]ethyl]benzene
CID 126542735
1-methyl-2-[2-(4-methylphenyl)ethylsulfanyl]benzene
CID 162413618

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene?
The IUPAC name of 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene (CID 143282666) is 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene.
What is the SMILES notation for 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene?
The canonical SMILES for 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene is Cc1ccc(CCc2c(C)cccc2C)cc1.
What is the InChIKey of 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene?
The InChIKey is RVSLRWHWKMUDNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20/c1-13-7-9-16(10-8-13)11-12-17-14(2)5-4-6-15(17)3/h4-10H,11-12H2,1-3H3.
What are the key properties of 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene?
1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene has a molecular weight of 224.35 g/mol, XLogP of 4.40, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2-[2-(4-methylphenyl)ethyl]benzene is sourced from PubChem (CID 143282666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).