2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate

C14H25NO3 — CID 91930397

IUPAC2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
SMILESCCC1(CCOC(C)=O)COC2(CCCCC2)N1
InChIInChI=1S/C14H25NO3/c1-3-13(9-10-17-12(2)16)11-18-14(15-13)7-5-4-6-8-14/h15H,3-11H2,1-2H3
InChIKeyDGIUCXZHLWCKHW-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.37
Rot. Bonds4

About 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate

2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate (PubChem CID 91930397) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate.

Molecular Properties

Compound Name2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
PubChem CID91930397
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
SMILESCCC1(CCOC(C)=O)COC2(CCCCC2)N1
InChIInChI=1S/C14H25NO3/c1-3-13(9-10-17-12(2)16)11-18-14(15-13)7-5-4-6-8-14/h15H,3-11H2,1-2H3
InChIKeyDGIUCXZHLWCKHW-UHFFFAOYSA-N
XLogP2.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-(2-Methoxyethyl)-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
CID 91930379
Methyl 3-(2-acetoxyethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxylate
CID 91930389
2-((S)-3-Methyl-1-oxa-4-azaspiro[4.5]decan-3-yl)propyl acetate
CID 91930391
2-(3-Isobutyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
CID 91930392
2-(3-Propyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
CID 91930394
2-(3-Methyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate
CID 91930400
(R)-2-(4-ethyl-2,2-dimethyloxazolidin-4-yl)ethyl acetate
CID 91930405
3,3-Diethyl-1-oxa-4-azaspiro[4.5]decane
CID 91932524
2-[(3R)-3-methyl-1-oxa-4-azaspiro[4.5]decan-3-yl]ethyl acetate
CID 138969293

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate?
The IUPAC name of 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate (CID 91930397) is 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate.
What is the SMILES notation for 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate?
The canonical SMILES for 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate is CCC1(CCOC(C)=O)COC2(CCCCC2)N1.
What is the InChIKey of 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate?
The InChIKey is DGIUCXZHLWCKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-3-13(9-10-17-12(2)16)11-18-14(15-13)7-5-4-6-8-14/h15H,3-11H2,1-2H3.
What are the key properties of 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate?
2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate has a molecular weight of 255.36 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-1-oxa-4-azaspiro[4.5]decan-3-yl)ethyl acetate is sourced from PubChem (CID 91930397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).