4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol

C15H28O2 — CID 163964872

IUPAC4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(OC1CCCCC1)C1CCC(O)CC1
InChIInChI=1S/C15H28O2/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h12-14,16H,3-11H2,1-2H3
InChIKeySKUJZVLSBHMDSE-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.67
Rot. Bonds3

About 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol

4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol (PubChem CID 163964872) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol
PubChem CID163964872
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol
SMILESCC(C)(OC1CCCCC1)C1CCC(O)CC1
InChIInChI=1S/C15H28O2/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h12-14,16H,3-11H2,1-2H3
InChIKeySKUJZVLSBHMDSE-UHFFFAOYSA-N
XLogP3.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol (CID 163964872) is 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol is CC(C)(OC1CCCCC1)C1CCC(O)CC1.
What is the InChIKey of 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol?
The InChIKey is SKUJZVLSBHMDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-15(2,12-8-10-13(16)11-9-12)17-14-6-4-3-5-7-14/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol?
4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclohexyloxypropan-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 163964872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).