ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate

C13H24N2O3 — CID 10445156

IUPACethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate
SMILESCCOC(=O)NC1CC2(CCN(C)CC2)OC1C
InChIInChI=1S/C13H24N2O3/c1-4-17-12(16)14-11-9-13(18-10(11)2)5-7-15(3)8-6-13/h10-11H,4-9H2,1-3H3,(H,14,16)
InChIKeyIWYCKPTXSUEXIM-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.37
Rot. Bonds2

About ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate

ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate (PubChem CID 10445156) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate.

Molecular Properties

Compound Nameethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate
PubChem CID10445156
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Nameethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate
SMILESCCOC(=O)NC1CC2(CCN(C)CC2)OC1C
InChIInChI=1S/C13H24N2O3/c1-4-17-12(16)14-11-9-13(18-10(11)2)5-7-15(3)8-6-13/h10-11H,4-9H2,1-3H3,(H,14,16)
InChIKeyIWYCKPTXSUEXIM-UHFFFAOYSA-N
XLogP1.37
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)acetamide
CID 10331287
tert-butyl N-{1-oxa-4-azaspiro[5.5]undecan-9-yl}carbamate
CID 132343729
Tert-butyl 2-(aminomethyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 71305748
Tert-butyl 3-amino-1-oxa-8-azaspiro[4.5]decane-8-carboxylate hydrochloride
CID 139026888
methyl N-(1-oxa-8-azaspiro[4.5]decan-2-ylmethyl)carbamate
CID 118741538
Tert-butyl 3-amino-1-oxa-7-azaspiro[4.5]decane-7-carboxylate
CID 71305868
Rac-tert-butyl (6r,9r)-9-amino-1-oxa-4-azaspiro[5.5]undecane-4-carboxylate
CID 82379209
Tert-butyl 2-(pyrrolidin-2-yl)morpholine-4-carboxylate
CID 82665346
Tert-butyl 2-(morpholin-3-yl)pyrrolidine-1-carboxylate
CID 82665351
tert-Butyl (2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)carbamate
CID 102564313
Tert-butyl 4-amino-1-oxa-8-azaspiro[4.5]decane-8-carboxylate
CID 105511886
rac-tert-butyl 4-((2R,3S)-3-aminooxolan-2-yl)piperidine-1-carboxylate
CID 121552399

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate?
The IUPAC name of ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate (CID 10445156) is ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate.
What is the SMILES notation for ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate?
The canonical SMILES for ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate is CCOC(=O)NC1CC2(CCN(C)CC2)OC1C.
What is the InChIKey of ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate?
The InChIKey is IWYCKPTXSUEXIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-4-17-12(16)14-11-9-13(18-10(11)2)5-7-15(3)8-6-13/h10-11H,4-9H2,1-3H3,(H,14,16).
What are the key properties of ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate?
ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate has a molecular weight of 256.35 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2,8-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-yl)carbamate is sourced from PubChem (CID 10445156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).