6-(cycloundecyloxymethyl)oxan-2-ol

C17H32O3 — CID 135181665

IUPAC6-(cycloundecyloxymethyl)oxan-2-ol
SMILESOC1CCCC(COC2CCCCCCCCCC2)O1
InChIInChI=1S/C17H32O3/c18-17-13-9-12-16(20-17)14-19-15-10-7-5-3-1-2-4-6-8-11-15/h15-18H,1-14H2
InChIKeyVSESDFXGEAURFS-UHFFFAOYSA-N
MW284.44 g/mol
LogP4.17
Rot. Bonds3

About 6-(cycloundecyloxymethyl)oxan-2-ol

6-(cycloundecyloxymethyl)oxan-2-ol (PubChem CID 135181665) has the molecular formula C17H32O3 and a molecular weight of 284.44 g/mol. Its IUPAC name is 6-(cycloundecyloxymethyl)oxan-2-ol.

Molecular Properties

Compound Name6-(cycloundecyloxymethyl)oxan-2-ol
PubChem CID135181665
Molecular FormulaC17H32O3
Molecular Weight284.44 g/mol
Exact Mass284.24
IUPAC Name6-(cycloundecyloxymethyl)oxan-2-ol
SMILESOC1CCCC(COC2CCCCCCCCCC2)O1
InChIInChI=1S/C17H32O3/c18-17-13-9-12-16(20-17)14-19-15-10-7-5-3-1-2-4-6-8-11-15/h15-18H,1-14H2
InChIKeyVSESDFXGEAURFS-UHFFFAOYSA-N
XLogP4.17
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(cycloundecyloxymethyl)oxan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(cycloundecyloxymethyl)oxan-2-ol?
The IUPAC name of 6-(cycloundecyloxymethyl)oxan-2-ol (CID 135181665) is 6-(cycloundecyloxymethyl)oxan-2-ol.
What is the SMILES notation for 6-(cycloundecyloxymethyl)oxan-2-ol?
The canonical SMILES for 6-(cycloundecyloxymethyl)oxan-2-ol is OC1CCCC(COC2CCCCCCCCCC2)O1.
What is the InChIKey of 6-(cycloundecyloxymethyl)oxan-2-ol?
The InChIKey is VSESDFXGEAURFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O3/c18-17-13-9-12-16(20-17)14-19-15-10-7-5-3-1-2-4-6-8-11-15/h15-18H,1-14H2.
What are the key properties of 6-(cycloundecyloxymethyl)oxan-2-ol?
6-(cycloundecyloxymethyl)oxan-2-ol has a molecular weight of 284.44 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cycloundecyloxymethyl)oxan-2-ol is sourced from PubChem (CID 135181665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).