4-methoxy-1-oxa-9-azaspiro[5.5]undecane

C10H19NO2 — CID 86820431

IUPAC4-methoxy-1-oxa-9-azaspiro[5.5]undecane
SMILESCOC1CCOC2(CCNCC2)C1
InChIInChI=1S/C10H19NO2/c1-12-9-2-7-13-10(8-9)3-5-11-6-4-10/h9,11H,2-8H2,1H3
InChIKeyDPZLCKLXOYKVPS-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.93
Rot. Bonds1

About 4-methoxy-1-oxa-9-azaspiro[5.5]undecane

4-methoxy-1-oxa-9-azaspiro[5.5]undecane (PubChem CID 86820431) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-methoxy-1-oxa-9-azaspiro[5.5]undecane.

Molecular Properties

Compound Name4-methoxy-1-oxa-9-azaspiro[5.5]undecane
PubChem CID86820431
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name4-methoxy-1-oxa-9-azaspiro[5.5]undecane
SMILESCOC1CCOC2(CCNCC2)C1
InChIInChI=1S/C10H19NO2/c1-12-9-2-7-13-10(8-9)3-5-11-6-4-10/h9,11H,2-8H2,1H3
InChIKeyDPZLCKLXOYKVPS-UHFFFAOYSA-N
XLogP0.93
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-oxa-9-azaspiro[5.5]undecane?
The IUPAC name of 4-methoxy-1-oxa-9-azaspiro[5.5]undecane (CID 86820431) is 4-methoxy-1-oxa-9-azaspiro[5.5]undecane.
What is the SMILES notation for 4-methoxy-1-oxa-9-azaspiro[5.5]undecane?
The canonical SMILES for 4-methoxy-1-oxa-9-azaspiro[5.5]undecane is COC1CCOC2(CCNCC2)C1.
What is the InChIKey of 4-methoxy-1-oxa-9-azaspiro[5.5]undecane?
The InChIKey is DPZLCKLXOYKVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-12-9-2-7-13-10(8-9)3-5-11-6-4-10/h9,11H,2-8H2,1H3.
What are the key properties of 4-methoxy-1-oxa-9-azaspiro[5.5]undecane?
4-methoxy-1-oxa-9-azaspiro[5.5]undecane has a molecular weight of 185.27 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-oxa-9-azaspiro[5.5]undecane is sourced from PubChem (CID 86820431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).