1-oxa-8-azaspiro[4.5]decan-3-one

C8H13NO2 — CID 10241028

IUPAC1-oxa-8-azaspiro[4.5]decan-3-one
SMILESO=C1COC2(CCNCC2)C1
InChIInChI=1S/C8H13NO2/c10-7-5-8(11-6-7)1-3-9-4-2-8/h9H,1-6H2
InChIKeyHQTYIRUSJRQGBS-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.10
Rot. Bonds

About 1-oxa-8-azaspiro[4.5]decan-3-one

1-oxa-8-azaspiro[4.5]decan-3-one (PubChem CID 10241028) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 1-oxa-8-azaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name1-oxa-8-azaspiro[4.5]decan-3-one
PubChem CID10241028
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name1-oxa-8-azaspiro[4.5]decan-3-one
SMILESO=C1COC2(CCNCC2)C1
InChIInChI=1S/C8H13NO2/c10-7-5-8(11-6-7)1-3-9-4-2-8/h9H,1-6H2
InChIKeyHQTYIRUSJRQGBS-UHFFFAOYSA-N
XLogP0.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-oxa-8-azaspiro[4.5]decan-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-oxa-8-azaspiro[4.5]decan-3-one?
The IUPAC name of 1-oxa-8-azaspiro[4.5]decan-3-one (CID 10241028) is 1-oxa-8-azaspiro[4.5]decan-3-one.
What is the SMILES notation for 1-oxa-8-azaspiro[4.5]decan-3-one?
The canonical SMILES for 1-oxa-8-azaspiro[4.5]decan-3-one is O=C1COC2(CCNCC2)C1.
What is the InChIKey of 1-oxa-8-azaspiro[4.5]decan-3-one?
The InChIKey is HQTYIRUSJRQGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c10-7-5-8(11-6-7)1-3-9-4-2-8/h9H,1-6H2.
What are the key properties of 1-oxa-8-azaspiro[4.5]decan-3-one?
1-oxa-8-azaspiro[4.5]decan-3-one has a molecular weight of 155.20 g/mol, XLogP of 0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-8-azaspiro[4.5]decan-3-one is sourced from PubChem (CID 10241028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).