2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane

C11H22N2O — CID 175690930

IUPAC2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESCCC1(C)CNCC2(CCNCC2)O1
InChIInChI=1S/C11H22N2O/c1-3-10(2)8-13-9-11(14-10)4-6-12-7-5-11/h12-13H,3-9H2,1-2H3
InChIKeyGRFDTFSFEIYZQP-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.90
Rot. Bonds1

About 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane

2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane (PubChem CID 175690930) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
PubChem CID175690930
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
SMILESCCC1(C)CNCC2(CCNCC2)O1
InChIInChI=1S/C11H22N2O/c1-3-10(2)8-13-9-11(14-10)4-6-12-7-5-11/h12-13H,3-9H2,1-2H3
InChIKeyGRFDTFSFEIYZQP-UHFFFAOYSA-N
XLogP0.90
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The IUPAC name of 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane (CID 175690930) is 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The canonical SMILES for 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane is CCC1(C)CNCC2(CCNCC2)O1.
What is the InChIKey of 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
The InChIKey is GRFDTFSFEIYZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-10(2)8-13-9-11(14-10)4-6-12-7-5-11/h12-13H,3-9H2,1-2H3.
What are the key properties of 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane?
2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane has a molecular weight of 198.31 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-1-oxa-4,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 175690930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).