3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one

C10H16N2O2 — CID 158349860

IUPAC3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one
SMILESCOC1=CC2(CCNCC2)N(C)C1=O
InChIInChI=1S/C10H16N2O2/c1-12-9(13)8(14-2)7-10(12)3-5-11-6-4-10/h7,11H,3-6H2,1-2H3
InChIKeyGSEITMKQJJYANA-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.11
Rot. Bonds1

About 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one

3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one (PubChem CID 158349860) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one
PubChem CID158349860
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one
SMILESCOC1=CC2(CCNCC2)N(C)C1=O
InChIInChI=1S/C10H16N2O2/c1-12-9(13)8(14-2)7-10(12)3-5-11-6-4-10/h7,11H,3-6H2,1-2H3
InChIKeyGSEITMKQJJYANA-UHFFFAOYSA-N
XLogP0.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-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 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one (CID 158349860) is 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one is COC1=CC2(CCNCC2)N(C)C1=O.
What is the InChIKey of 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one?
The InChIKey is GSEITMKQJJYANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-12-9(13)8(14-2)7-10(12)3-5-11-6-4-10/h7,11H,3-6H2,1-2H3.
What are the key properties of 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one?
3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one has a molecular weight of 196.25 g/mol, XLogP of 0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 158349860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).