2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane

C14H27NO — CID 114497312

IUPAC2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCCC1(C)CNCC2(CC(C)CCC2C)O1
InChIInChI=1S/C14H27NO/c1-5-13(4)9-15-10-14(16-13)8-11(2)6-7-12(14)3/h11-12,15H,5-10H2,1-4H3
InChIKeyJRTUCFZWJSMSGY-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds1

About 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane

2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane (PubChem CID 114497312) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane.

Molecular Properties

Compound Name2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane
PubChem CID114497312
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCCC1(C)CNCC2(CC(C)CCC2C)O1
InChIInChI=1S/C14H27NO/c1-5-13(4)9-15-10-14(16-13)8-11(2)6-7-12(14)3/h11-12,15H,5-10H2,1-4H3
InChIKeyJRTUCFZWJSMSGY-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane?
The IUPAC name of 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane (CID 114497312) is 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane.
What is the SMILES notation for 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane?
The canonical SMILES for 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane is CCC1(C)CNCC2(CC(C)CCC2C)O1.
What is the InChIKey of 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane?
The InChIKey is JRTUCFZWJSMSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-5-13(4)9-15-10-14(16-13)8-11(2)6-7-12(14)3/h11-12,15H,5-10H2,1-4H3.
What are the key properties of 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane?
2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane has a molecular weight of 225.38 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,8,11-trimethyl-1-oxa-4-azaspiro[5.5]undecane is sourced from PubChem (CID 114497312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).