9-ethyl-2-oxa-9-azaspiro[5.5]undecane

C11H21NO — CID 89417730

IUPAC9-ethyl-2-oxa-9-azaspiro[5.5]undecane
SMILESCCN1CCC2(CCCOC2)CC1
InChIInChI=1S/C11H21NO/c1-2-12-7-5-11(6-8-12)4-3-9-13-10-11/h2-10H2,1H3
InChIKeyZAQBRSGFAORKQS-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds1

About 9-ethyl-2-oxa-9-azaspiro[5.5]undecane

9-ethyl-2-oxa-9-azaspiro[5.5]undecane (PubChem CID 89417730) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 9-ethyl-2-oxa-9-azaspiro[5.5]undecane.

Molecular Properties

Compound Name9-ethyl-2-oxa-9-azaspiro[5.5]undecane
PubChem CID89417730
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name9-ethyl-2-oxa-9-azaspiro[5.5]undecane
SMILESCCN1CCC2(CCCOC2)CC1
InChIInChI=1S/C11H21NO/c1-2-12-7-5-11(6-8-12)4-3-9-13-10-11/h2-10H2,1H3
InChIKeyZAQBRSGFAORKQS-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-2-oxa-9-azaspiro[5.5]undecane?
The IUPAC name of 9-ethyl-2-oxa-9-azaspiro[5.5]undecane (CID 89417730) is 9-ethyl-2-oxa-9-azaspiro[5.5]undecane.
What is the SMILES notation for 9-ethyl-2-oxa-9-azaspiro[5.5]undecane?
The canonical SMILES for 9-ethyl-2-oxa-9-azaspiro[5.5]undecane is CCN1CCC2(CCCOC2)CC1.
What is the InChIKey of 9-ethyl-2-oxa-9-azaspiro[5.5]undecane?
The InChIKey is ZAQBRSGFAORKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-12-7-5-11(6-8-12)4-3-9-13-10-11/h2-10H2,1H3.
What are the key properties of 9-ethyl-2-oxa-9-azaspiro[5.5]undecane?
9-ethyl-2-oxa-9-azaspiro[5.5]undecane has a molecular weight of 183.29 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-2-oxa-9-azaspiro[5.5]undecane is sourced from PubChem (CID 89417730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).