11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione

C10H15NO2S — CID 79318263

IUPAC11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione
SMILESCC1C(=O)NC(=O)CC12CCCSC2
InChIInChI=1S/C10H15NO2S/c1-7-9(13)11-8(12)5-10(7)3-2-4-14-6-10/h7H,2-6H2,1H3,(H,11,12,13)
InChIKeyOGUPGIFHRWRDIY-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.18
Rot. Bonds

About 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione

11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione (PubChem CID 79318263) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione.

Molecular Properties

Compound Name11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione
PubChem CID79318263
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione
SMILESCC1C(=O)NC(=O)CC12CCCSC2
InChIInChI=1S/C10H15NO2S/c1-7-9(13)11-8(12)5-10(7)3-2-4-14-6-10/h7H,2-6H2,1H3,(H,11,12,13)
InChIKeyOGUPGIFHRWRDIY-UHFFFAOYSA-N
XLogP1.18
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione 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 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione?
The IUPAC name of 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione (CID 79318263) is 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione.
What is the SMILES notation for 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione?
The canonical SMILES for 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione is CC1C(=O)NC(=O)CC12CCCSC2.
What is the InChIKey of 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione?
The InChIKey is OGUPGIFHRWRDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-7-9(13)11-8(12)5-10(7)3-2-4-14-6-10/h7H,2-6H2,1H3,(H,11,12,13).
What are the key properties of 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione?
11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione has a molecular weight of 213.30 g/mol, XLogP of 1.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-2-thia-9-azaspiro[5.5]undecane-8,10-dione is sourced from PubChem (CID 79318263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).