2-ethyl-1-methyl-4-(4-methylphenyl)benzene

C16H18 — CID 59090118

IUPAC2-ethyl-1-methyl-4-(4-methylphenyl)benzene
SMILESCCc1cc(-c2ccc(C)cc2)ccc1C
InChIInChI=1S/C16H18/c1-4-14-11-16(10-7-13(14)3)15-8-5-12(2)6-9-15/h5-11H,4H2,1-3H3
InChIKeyWLMQGPKTNOBEMS-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.53
Rot. Bonds2

About 2-ethyl-1-methyl-4-(4-methylphenyl)benzene

2-ethyl-1-methyl-4-(4-methylphenyl)benzene (PubChem CID 59090118) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-ethyl-1-methyl-4-(4-methylphenyl)benzene.

Molecular Properties

Compound Name2-ethyl-1-methyl-4-(4-methylphenyl)benzene
PubChem CID59090118
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Name2-ethyl-1-methyl-4-(4-methylphenyl)benzene
SMILESCCc1cc(-c2ccc(C)cc2)ccc1C
InChIInChI=1S/C16H18/c1-4-14-11-16(10-7-13(14)3)15-8-5-12(2)6-9-15/h5-11H,4H2,1-3H3
InChIKeyWLMQGPKTNOBEMS-UHFFFAOYSA-N
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-(3,4-dimethylphenyl)-2-ethyl-1-methylbenzene
CID 123136977
4-(4-chlorophenyl)-2-ethyl-1-methylbenzene
CID 22968913
2-ethyl-1-methyl-4-(4-propylphenyl)benzene
CID 123879424
[2-methyl-5-(4-methylphenyl)phenyl]methanamine
CID 115027522
1-ethyl-3,5-dimethylbenzene;2-ethyl-1,4-dimethylbenzene
CID 160945990
2-[2-methyl-5-[3-(4-methylphenyl)phenyl]phenyl]acetic acid
CID 68810177
1,2-dimethyl-4-[4-(4-methylphenyl)phenyl]benzene
CID 20704293
2-ethyl-4-(2-iodophenyl)-1-methylbenzene
CID 142879515
4-(4-methylphenyl)-1,2-dipropylbenzene
CID 159068290
4-(3,4-dimethylphenyl)-2-ethylaniline
CID 81287148
2-ethyl-4-[2-(3-ethyl-4-methylphenyl)ethyl]-1-methylbenzene
CID 123325932
N-[(2S)-4-[2-methyl-5-(4-methylphenyl)phenyl]butan-2-yl]formamide
CID 176925575

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methyl-4-(4-methylphenyl)benzene?
The IUPAC name of 2-ethyl-1-methyl-4-(4-methylphenyl)benzene (CID 59090118) is 2-ethyl-1-methyl-4-(4-methylphenyl)benzene.
What is the SMILES notation for 2-ethyl-1-methyl-4-(4-methylphenyl)benzene?
The canonical SMILES for 2-ethyl-1-methyl-4-(4-methylphenyl)benzene is CCc1cc(-c2ccc(C)cc2)ccc1C.
What is the InChIKey of 2-ethyl-1-methyl-4-(4-methylphenyl)benzene?
The InChIKey is WLMQGPKTNOBEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18/c1-4-14-11-16(10-7-13(14)3)15-8-5-12(2)6-9-15/h5-11H,4H2,1-3H3.
What are the key properties of 2-ethyl-1-methyl-4-(4-methylphenyl)benzene?
2-ethyl-1-methyl-4-(4-methylphenyl)benzene has a molecular weight of 210.32 g/mol, XLogP of 4.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methyl-4-(4-methylphenyl)benzene is sourced from PubChem (CID 59090118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).