3-(cyclohexyloxymethyl)oxetane

C10H18O2 — CID 67973295

IUPAC3-(cyclohexyloxymethyl)oxetane
SMILESC1CCC(OCC2COC2)CC1
InChIInChI=1S/C10H18O2/c1-2-4-10(5-3-1)12-8-9-6-11-7-9/h9-10H,1-8H2
InChIKeyOUYSDHCAXZNYRP-UHFFFAOYSA-N
MW170.25 g/mol
LogP1.98
Rot. Bonds3

About 3-(cyclohexyloxymethyl)oxetane

3-(cyclohexyloxymethyl)oxetane (PubChem CID 67973295) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 3-(cyclohexyloxymethyl)oxetane.

Molecular Properties

Compound Name3-(cyclohexyloxymethyl)oxetane
PubChem CID67973295
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name3-(cyclohexyloxymethyl)oxetane
SMILESC1CCC(OCC2COC2)CC1
InChIInChI=1S/C10H18O2/c1-2-4-10(5-3-1)12-8-9-6-11-7-9/h9-10H,1-8H2
InChIKeyOUYSDHCAXZNYRP-UHFFFAOYSA-N
XLogP1.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexyloxymethyl)oxetane?
The IUPAC name of 3-(cyclohexyloxymethyl)oxetane (CID 67973295) is 3-(cyclohexyloxymethyl)oxetane.
What is the SMILES notation for 3-(cyclohexyloxymethyl)oxetane?
The canonical SMILES for 3-(cyclohexyloxymethyl)oxetane is C1CCC(OCC2COC2)CC1.
What is the InChIKey of 3-(cyclohexyloxymethyl)oxetane?
The InChIKey is OUYSDHCAXZNYRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-2-4-10(5-3-1)12-8-9-6-11-7-9/h9-10H,1-8H2.
What are the key properties of 3-(cyclohexyloxymethyl)oxetane?
3-(cyclohexyloxymethyl)oxetane has a molecular weight of 170.25 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexyloxymethyl)oxetane is sourced from PubChem (CID 67973295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).