1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate

C11H20N2O3 — CID 102930703

IUPAC1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate
SMILESCCNC(=O)OC1COC2(CCNCC2)C1
InChIInChI=1S/C11H20N2O3/c1-2-13-10(14)16-9-7-11(15-8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyTVBFLCNBCXRRCW-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.64
Rot. Bonds2

About 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate

1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate (PubChem CID 102930703) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate.

Molecular Properties

Compound Name1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate
PubChem CID102930703
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate
SMILESCCNC(=O)OC1COC2(CCNCC2)C1
InChIInChI=1S/C11H20N2O3/c1-2-13-10(14)16-9-7-11(15-8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyTVBFLCNBCXRRCW-UHFFFAOYSA-N
XLogP0.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-oxa-8-azaspiro[4.5]decan-3-yl N-cyclobutylcarbamate
CID 102930707
N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
CID 102930345
1-oxa-8-azaspiro[4.5]decan-3-yl N-benzylcarbamate
CID 107654733
1-oxa-8-azaspiro[4.5]decan-3-yl N,N-dimethylcarbamate
CID 102930688
azetidin-3-yl N-ethylcarbamate
CID 79338252
N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
CID 102930304
methyl 2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanoate
CID 106941120
N,N-dimethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)acetamide
CID 102930339
N-tert-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)acetamide
CID 102930376
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pentanoic acid
CID 106941098
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)-N-propan-2-ylpropanamide
CID 102930305
3-(2-methylsulfonylethoxy)-1-oxa-8-azaspiro[4.5]decane
CID 102930216

Frequently Asked Questions

What is the IUPAC name of 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate?
The IUPAC name of 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate (CID 102930703) is 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate.
What is the SMILES notation for 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate?
The canonical SMILES for 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate is CCNC(=O)OC1COC2(CCNCC2)C1.
What is the InChIKey of 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate?
The InChIKey is TVBFLCNBCXRRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-2-13-10(14)16-9-7-11(15-8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14).
What are the key properties of 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate?
1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate has a molecular weight of 228.29 g/mol, XLogP of 0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate is sourced from PubChem (CID 102930703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).