2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane

C13H25NO — CID 65122151

IUPAC2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCCC1CNCC2(CCCC(C)C2C)O1
InChIInChI=1S/C13H25NO/c1-4-12-8-14-9-13(15-12)7-5-6-10(2)11(13)3/h10-12,14H,4-9H2,1-3H3
InChIKeyZUEXNAMQSFWAMP-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.58
Rot. Bonds1

About 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane

2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane (PubChem CID 65122151) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane.

Molecular Properties

Compound Name2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane
PubChem CID65122151
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane
SMILESCCC1CNCC2(CCCC(C)C2C)O1
InChIInChI=1S/C13H25NO/c1-4-12-8-14-9-13(15-12)7-5-6-10(2)11(13)3/h10-12,14H,4-9H2,1-3H3
InChIKeyZUEXNAMQSFWAMP-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-tert-butyl-2-ethyl-1-oxa-4-azaspiro[5.5]undecane
CID 65122254
2-ethyl-9-propyl-1-oxa-4-azaspiro[5.6]dodecane
CID 65122152
(5S,7S)-7-ethyl-2,6-dioxa-9-azaspiro[4.5]decane
CID 96936612
(5S,7R)-7-ethyl-2,6-dioxa-9-azaspiro[4.5]decane
CID 96936611
2-(methoxymethyl)-10-methyl-1-oxa-4-azaspiro[5.5]undecane
CID 65116066
6-ethyl-2-methyl-2-(2-methylpropyl)morpholine
CID 65122203
but-1-ene;1,1,2,3-tetramethylcyclohexane
CID 142112432
6-ethyl-2-methyl-2-pentylmorpholine
CID 80558910
6'-ethylspiro[1,2-dihydroindene-3,2'-morpholine]
CID 65122572
2-ethyl-10-propan-2-yl-1,9-dioxa-4-azaspiro[5.5]undecane
CID 65122724
2-(methoxymethyl)-9-methyl-1-oxa-4-azaspiro[5.5]undecane
CID 65117870
6,7-dimethyl-2-azaspiro[4.5]decane-4-carboxylic acid
CID 64754215

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane?
The IUPAC name of 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane (CID 65122151) is 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane.
What is the SMILES notation for 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane?
The canonical SMILES for 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane is CCC1CNCC2(CCCC(C)C2C)O1.
What is the InChIKey of 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane?
The InChIKey is ZUEXNAMQSFWAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-4-12-8-14-9-13(15-12)7-5-6-10(2)11(13)3/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane?
2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane has a molecular weight of 211.35 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-10,11-dimethyl-1-oxa-4-azaspiro[5.5]undecane is sourced from PubChem (CID 65122151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).