3-(4-cyclohexylphenyl)oxetan-3-ol

C15H20O2 — CID 116872960

IUPAC3-(4-cyclohexylphenyl)oxetan-3-ol
SMILESOC1(c2ccc(C3CCCCC3)cc2)COC1
InChIInChI=1S/C15H20O2/c16-15(10-17-11-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12,16H,1-5,10-11H2
InChIKeyJXUINDQQQULQRY-UHFFFAOYSA-N
MW232.32 g/mol
LogP2.95
Rot. Bonds2

About 3-(4-cyclohexylphenyl)oxetan-3-ol

3-(4-cyclohexylphenyl)oxetan-3-ol (PubChem CID 116872960) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 3-(4-cyclohexylphenyl)oxetan-3-ol.

Molecular Properties

Compound Name3-(4-cyclohexylphenyl)oxetan-3-ol
PubChem CID116872960
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name3-(4-cyclohexylphenyl)oxetan-3-ol
SMILESOC1(c2ccc(C3CCCCC3)cc2)COC1
InChIInChI=1S/C15H20O2/c16-15(10-17-11-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12,16H,1-5,10-11H2
InChIKeyJXUINDQQQULQRY-UHFFFAOYSA-N
XLogP2.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclohexylphenyl)oxetan-3-ol?
The IUPAC name of 3-(4-cyclohexylphenyl)oxetan-3-ol (CID 116872960) is 3-(4-cyclohexylphenyl)oxetan-3-ol.
What is the SMILES notation for 3-(4-cyclohexylphenyl)oxetan-3-ol?
The canonical SMILES for 3-(4-cyclohexylphenyl)oxetan-3-ol is OC1(c2ccc(C3CCCCC3)cc2)COC1.
What is the InChIKey of 3-(4-cyclohexylphenyl)oxetan-3-ol?
The InChIKey is JXUINDQQQULQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c16-15(10-17-11-15)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-9,12,16H,1-5,10-11H2.
What are the key properties of 3-(4-cyclohexylphenyl)oxetan-3-ol?
3-(4-cyclohexylphenyl)oxetan-3-ol has a molecular weight of 232.32 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclohexylphenyl)oxetan-3-ol is sourced from PubChem (CID 116872960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).