N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide

C13H24N2O3 — CID 102930345

IUPACN-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
SMILESCCNC(=O)C(C)OC1COC2(CCNCC2)C1
InChIInChI=1S/C13H24N2O3/c1-3-15-12(16)10(2)18-11-8-13(17-9-11)4-6-14-7-5-13/h10-11,14H,3-9H2,1-2H3,(H,15,16)
InChIKeyMVBNMRZEWAXEAV-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.44
Rot. Bonds4

About N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide

N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide (PubChem CID 102930345) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide.

Molecular Properties

Compound NameN-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
PubChem CID102930345
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
SMILESCCNC(=O)C(C)OC1COC2(CCNCC2)C1
InChIInChI=1S/C13H24N2O3/c1-3-15-12(16)10(2)18-11-8-13(17-9-11)4-6-14-7-5-13/h10-11,14H,3-9H2,1-2H3,(H,15,16)
InChIKeyMVBNMRZEWAXEAV-UHFFFAOYSA-N
XLogP0.44
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide
CID 102930304
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)-N-propan-2-ylpropanamide
CID 102930305
methyl 2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanoate
CID 106941120
1-oxa-8-azaspiro[4.5]decan-3-yl N-ethylcarbamate
CID 102930703
2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)pentanoic acid
CID 106941098
3-(2-methylsulfonylethoxy)-1-oxa-8-azaspiro[4.5]decane
CID 102930216
1-oxa-8-azaspiro[4.5]decan-3-yl N,N-dimethylcarbamate
CID 102930688
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
1-oxa-8-azaspiro[4.5]decan-3-yl N-cyclobutylcarbamate
CID 102930707
1-oxa-8-azaspiro[4.5]decan-3-yl N-benzylcarbamate
CID 107654733
3-(3,3-diethoxypropoxy)-1-oxa-8-azaspiro[4.5]decane
CID 102930291

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The IUPAC name of N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide (CID 102930345) is N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide.
What is the SMILES notation for N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The canonical SMILES for N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide is CCNC(=O)C(C)OC1COC2(CCNCC2)C1.
What is the InChIKey of N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
The InChIKey is MVBNMRZEWAXEAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-3-15-12(16)10(2)18-11-8-13(17-9-11)4-6-14-7-5-13/h10-11,14H,3-9H2,1-2H3,(H,15,16).
What are the key properties of N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide?
N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide has a molecular weight of 256.35 g/mol, XLogP of 0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-oxa-8-azaspiro[4.5]decan-3-yloxy)propanamide is sourced from PubChem (CID 102930345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).