2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol

C14H20O4 — CID 60878416

IUPAC2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol
SMILESCOc1cc(OC)cc(OC2CCCCC2O)c1
InChIInChI=1S/C14H20O4/c1-16-10-7-11(17-2)9-12(8-10)18-14-6-4-3-5-13(14)15/h7-9,13-15H,3-6H2,1-2H3
InChIKeyARYOQLCVHORGMZ-UHFFFAOYSA-N
MW252.31 g/mol
LogP2.39
Rot. Bonds4

About 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol

2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol (PubChem CID 60878416) has the molecular formula C14H20O4 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol
PubChem CID60878416
Molecular FormulaC14H20O4
Molecular Weight252.31 g/mol
Exact Mass252.14
IUPAC Name2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol
SMILESCOc1cc(OC)cc(OC2CCCCC2O)c1
InChIInChI=1S/C14H20O4/c1-16-10-7-11(17-2)9-12(8-10)18-14-6-4-3-5-13(14)15/h7-9,13-15H,3-6H2,1-2H3
InChIKeyARYOQLCVHORGMZ-UHFFFAOYSA-N
XLogP2.39
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol?
The IUPAC name of 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol (CID 60878416) is 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol.
What is the SMILES notation for 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol?
The canonical SMILES for 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol is COc1cc(OC)cc(OC2CCCCC2O)c1.
What is the InChIKey of 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol?
The InChIKey is ARYOQLCVHORGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O4/c1-16-10-7-11(17-2)9-12(8-10)18-14-6-4-3-5-13(14)15/h7-9,13-15H,3-6H2,1-2H3.
What are the key properties of 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol?
2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol has a molecular weight of 252.31 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethoxyphenoxy)cyclohexan-1-ol is sourced from PubChem (CID 60878416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).