8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C9H16N2O2 — CID 20622668

IUPAC8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCN1CCC2(CC1)CNC(=O)O2
InChIInChI=1S/C9H16N2O2/c1-2-11-5-3-9(4-6-11)7-10-8(12)13-9/h2-7H2,1H3,(H,10,12)
InChIKeyJAOZUGHUNZPTIX-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.58
Rot. Bonds1

About 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 20622668) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID20622668
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCN1CCC2(CC1)CNC(=O)O2
InChIInChI=1S/C9H16N2O2/c1-2-11-5-3-9(4-6-11)7-10-8(12)13-9/h2-7H2,1H3,(H,10,12)
InChIKeyJAOZUGHUNZPTIX-UHFFFAOYSA-N
XLogP0.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 20622668) is 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is CCN1CCC2(CC1)CNC(=O)O2.
What is the InChIKey of 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is JAOZUGHUNZPTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-11-5-3-9(4-6-11)7-10-8(12)13-9/h2-7H2,1H3,(H,10,12).
What are the key properties of 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 184.24 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 20622668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).