1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane

C18H34 — CID 154060450

IUPAC1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1C(C)(C)C1CCCCC1
InChIInChI=1S/C18H34/c1-14(2)16-12-8-9-13-17(16)18(3,4)15-10-6-5-7-11-15/h14-17H,5-13H2,1-4H3
InChIKeyRRVUEYMXEHYBPM-UHFFFAOYSA-N
MW250.47 g/mol
LogP6.06
Rot. Bonds3

About 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane

1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane (PubChem CID 154060450) has the molecular formula C18H34 and a molecular weight of 250.47 g/mol. Its IUPAC name is 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane.

Molecular Properties

Compound Name1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane
PubChem CID154060450
Molecular FormulaC18H34
Molecular Weight250.47 g/mol
Exact Mass250.27
IUPAC Name1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1C(C)(C)C1CCCCC1
InChIInChI=1S/C18H34/c1-14(2)16-12-8-9-13-17(16)18(3,4)15-10-6-5-7-11-15/h14-17H,5-13H2,1-4H3
InChIKeyRRVUEYMXEHYBPM-UHFFFAOYSA-N
XLogP6.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.47
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane?
The IUPAC name of 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane (CID 154060450) is 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane.
What is the SMILES notation for 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane?
The canonical SMILES for 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane is CC(C)C1CCCCC1C(C)(C)C1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane?
The InChIKey is RRVUEYMXEHYBPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34/c1-14(2)16-12-8-9-13-17(16)18(3,4)15-10-6-5-7-11-15/h14-17H,5-13H2,1-4H3.
What are the key properties of 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane?
1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane has a molecular weight of 250.47 g/mol, XLogP of 6.06, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylpropan-2-yl)-2-propan-2-ylcyclohexane is sourced from PubChem (CID 154060450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).