3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine

C12H21NO2 — CID 165499811

IUPAC3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine
SMILESC1CC(COC2CNC2)OC2(C1)CCC2
InChIInChI=1S/C12H21NO2/c1-3-10(9-14-11-7-13-8-11)15-12(4-1)5-2-6-12/h10-11,13H,1-9H2
InChIKeyKSZSFCCLLZRWCP-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.47
Rot. Bonds3

About 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine

3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine (PubChem CID 165499811) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine.

Molecular Properties

Compound Name3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine
PubChem CID165499811
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine
SMILESC1CC(COC2CNC2)OC2(C1)CCC2
InChIInChI=1S/C12H21NO2/c1-3-10(9-14-11-7-13-8-11)15-12(4-1)5-2-6-12/h10-11,13H,1-9H2
InChIKeyKSZSFCCLLZRWCP-UHFFFAOYSA-N
XLogP1.47
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine?
The IUPAC name of 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine (CID 165499811) is 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine.
What is the SMILES notation for 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine?
The canonical SMILES for 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine is C1CC(COC2CNC2)OC2(C1)CCC2.
What is the InChIKey of 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine?
The InChIKey is KSZSFCCLLZRWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-3-10(9-14-11-7-13-8-11)15-12(4-1)5-2-6-12/h10-11,13H,1-9H2.
What are the key properties of 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine?
3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine has a molecular weight of 211.30 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-oxaspiro[3.5]nonan-6-ylmethoxy)azetidine is sourced from PubChem (CID 165499811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).