9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane

C13H25NO2 — CID 103968922

IUPAC9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
SMILESCCOCC1CNCC2(CCCCC2)CO1
InChIInChI=1S/C13H25NO2/c1-2-15-9-12-8-14-10-13(11-16-12)6-4-3-5-7-13/h12,14H,2-11H2,1H3
InChIKeyWQDLJSRPYWEDCK-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.96
Rot. Bonds3

About 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane

9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane (PubChem CID 103968922) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
PubChem CID103968922
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
SMILESCCOCC1CNCC2(CCCCC2)CO1
InChIInChI=1S/C13H25NO2/c1-2-15-9-12-8-14-10-13(11-16-12)6-4-3-5-7-13/h12,14H,2-11H2,1H3
InChIKeyWQDLJSRPYWEDCK-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-(methoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane
CID 103968945
9-(2,4,6-trimethylphenyl)-8-oxa-11-azaspiro[5.6]dodecane
CID 103968892
3-ethyl-2-oxaspiro[4.5]decane
CID 102162651
3-(methoxymethyl)-4-oxa-1-azaspiro[5.5]undecane
CID 63930005
9-(2-methylphenyl)-8-oxa-11-azaspiro[5.6]dodecane
CID 103968950
8-(3-methylthiophen-2-yl)-7-oxa-10-azaspiro[4.6]undecane
CID 113294388
(2S)-6,6-difluoro-2-(propan-2-yloxymethyl)-1,4-oxazepane
CID 176863619
9-(3,4-dichlorophenyl)-8-oxa-11-azaspiro[5.6]dodecane
CID 103968917
8-(2-methoxy-5-methylphenyl)-7-oxa-10-azaspiro[4.6]undecane
CID 115362003
2-azaspiro[4.5]decane;ethyl formate
CID 144702388
6-(ethoxymethyl)-1,3-oxazinane
CID 19874139
8-(4-tert-butylphenyl)-7-oxa-10-azaspiro[4.6]undecane
CID 115361978

Frequently Asked Questions

What is the IUPAC name of 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The IUPAC name of 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane (CID 103968922) is 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane.
What is the SMILES notation for 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The canonical SMILES for 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane is CCOCC1CNCC2(CCCCC2)CO1.
What is the InChIKey of 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
The InChIKey is WQDLJSRPYWEDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-2-15-9-12-8-14-10-13(11-16-12)6-4-3-5-7-13/h12,14H,2-11H2,1H3.
What are the key properties of 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane?
9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane has a molecular weight of 227.35 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(ethoxymethyl)-8-oxa-11-azaspiro[5.6]dodecane is sourced from PubChem (CID 103968922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).