3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol

C15H26O3 — CID 66368745

IUPAC3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol
SMILESOC1CC(OCC2CCCO2)C12CCCCCC2
InChIInChI=1S/C15H26O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12-14,16H,1-11H2
InChIKeyWNWDZTIKCRZXDD-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.66
Rot. Bonds3

About 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol

3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol (PubChem CID 66368745) has the molecular formula C15H26O3 and a molecular weight of 254.37 g/mol. Its IUPAC name is 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol.

Molecular Properties

Compound Name3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol
PubChem CID66368745
Molecular FormulaC15H26O3
Molecular Weight254.37 g/mol
Exact Mass254.19
IUPAC Name3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol
SMILESOC1CC(OCC2CCCO2)C12CCCCCC2
InChIInChI=1S/C15H26O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12-14,16H,1-11H2
InChIKeyWNWDZTIKCRZXDD-UHFFFAOYSA-N
XLogP2.66
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol?
The IUPAC name of 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol (CID 66368745) is 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol.
What is the SMILES notation for 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol?
The canonical SMILES for 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol is OC1CC(OCC2CCCO2)C12CCCCCC2.
What is the InChIKey of 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol?
The InChIKey is WNWDZTIKCRZXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O3/c16-13-10-14(18-11-12-6-5-9-17-12)15(13)7-3-1-2-4-8-15/h12-14,16H,1-11H2.
What are the key properties of 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol?
3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol has a molecular weight of 254.37 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-2-ylmethoxy)spiro[3.6]decan-1-ol is sourced from PubChem (CID 66368745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).