2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene

C24H32 — CID 175137284

IUPAC2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene
SMILESCC(C)(c1ccccc1)C1(C(C)(C)c2ccccc2)CCCCC1
InChIInChI=1S/C24H32/c1-22(2,20-14-8-5-9-15-20)24(18-12-7-13-19-24)23(3,4)21-16-10-6-11-17-21/h5-6,8-11,14-17H,7,12-13,18-19H2,1-4H3
InChIKeyCCENHQLINSXYJS-UHFFFAOYSA-N
MW320.52 g/mol
LogP6.89
Rot. Bonds4

About 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene

2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene (PubChem CID 175137284) has the molecular formula C24H32 and a molecular weight of 320.52 g/mol. Its IUPAC name is 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene.

Molecular Properties

Compound Name2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene
PubChem CID175137284
Molecular FormulaC24H32
Molecular Weight320.52 g/mol
Exact Mass320.25
IUPAC Name2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene
SMILESCC(C)(c1ccccc1)C1(C(C)(C)c2ccccc2)CCCCC1
InChIInChI=1S/C24H32/c1-22(2,20-14-8-5-9-15-20)24(18-12-7-13-19-24)23(3,4)21-16-10-6-11-17-21/h5-6,8-11,14-17H,7,12-13,18-19H2,1-4H3
InChIKeyCCENHQLINSXYJS-UHFFFAOYSA-N
XLogP6.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.52
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-(2-phenylpropan-2-yl)bicyclo[3.1.0]hexan-6-ol
CID 79331247
7-(2-phenylpropan-2-yl)bicyclo[4.1.0]heptan-7-amine
CID 79331599
N-methyl-1-(2-phenylpropan-2-yl)cyclopropan-1-amine
CID 83684635
bicyclo[2.2.0]hexane;tert-butylbenzene
CID 174393348
CID 171375456
CID 171375456
tert-butylbenzene;cyclohexylbenzene
CID 158089404
tert-butylbenzene;methanamine;7-thiabicyclo[4.1.0]heptane
CID 174813455
tert-butylbenzene;molecular nitrogen
CID 146464751
tert-butylbenzene;chloromethane;ethane
CID 91149652
tert-butylbenzene;2,2-dimethylpropane;methane
CID 160959011
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454
tert-butylbenzene;methanimine
CID 174908280

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene?
The IUPAC name of 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene (CID 175137284) is 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene.
What is the SMILES notation for 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene?
The canonical SMILES for 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene is CC(C)(c1ccccc1)C1(C(C)(C)c2ccccc2)CCCCC1.
What is the InChIKey of 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene?
The InChIKey is CCENHQLINSXYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32/c1-22(2,20-14-8-5-9-15-20)24(18-12-7-13-19-24)23(3,4)21-16-10-6-11-17-21/h5-6,8-11,14-17H,7,12-13,18-19H2,1-4H3.
What are the key properties of 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene?
2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene has a molecular weight of 320.52 g/mol, XLogP of 6.89, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-phenylpropan-2-yl)cyclohexyl]propan-2-ylbenzene is sourced from PubChem (CID 175137284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).