1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene

C16H24 — CID 23529825

IUPAC1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene
SMILESCc1ccc(C2CCC(C)CC2C)c(C)c1
InChIInChI=1S/C16H24/c1-11-5-7-15(13(3)9-11)16-8-6-12(2)10-14(16)4/h5,7,9,12,14,16H,6,8,10H2,1-4H3
InChIKeyOYZUBJZQYXETHF-UHFFFAOYSA-N
MW216.37 g/mol
LogP4.84
Rot. Bonds1

About 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene

1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene (PubChem CID 23529825) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene.

Molecular Properties

Compound Name1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene
PubChem CID23529825
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene
SMILESCc1ccc(C2CCC(C)CC2C)c(C)c1
InChIInChI=1S/C16H24/c1-11-5-7-15(13(3)9-11)16-8-6-12(2)10-14(16)4/h5,7,9,12,14,16H,6,8,10H2,1-4H3
InChIKeyOYZUBJZQYXETHF-UHFFFAOYSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,4-dimethyl-1-(2-methylcyclopropyl)benzene
CID 154093761
2-(2,4-dimethylphenyl)-4-methylcyclohexane-1-carboxylic acid
CID 81020459
trans-(1R,2S)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
CID 93299529
1-(2-bromocyclopropyl)-2,4-dimethylbenzene
CID 130539902
2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane
CID 15514590
2,7-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene
CID 21032882
2-(2,4-dimethylphenyl)cyclopropane-1-carbonitrile
CID 116836914
4-methyl-2-[2-methyl-4-(trifluoromethyl)phenyl]cyclohexan-1-amine
CID 102756356
N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
CID 135160107
4-(2,4-dimethylphenyl)-2,6-dimethylpiperidine
CID 142342615
ethane;methylcyclopropane;1,3-xylene
CID 142338532
[2-(2,4-dimethylphenyl)cycloheptyl]methanamine
CID 81011171

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene?
The IUPAC name of 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene (CID 23529825) is 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene.
What is the SMILES notation for 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene?
The canonical SMILES for 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene is Cc1ccc(C2CCC(C)CC2C)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene?
The InChIKey is OYZUBJZQYXETHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-11-5-7-15(13(3)9-11)16-8-6-12(2)10-14(16)4/h5,7,9,12,14,16H,6,8,10H2,1-4H3.
What are the key properties of 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene?
1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene has a molecular weight of 216.37 g/mol, XLogP of 4.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene is sourced from PubChem (CID 23529825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).