3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione

C13H20N2O2 — CID 116658437

IUPAC3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)NC(=O)N1C1CCC1
InChIInChI=1S/C13H20N2O2/c16-11-9-13(7-2-1-3-8-13)14-12(17)15(11)10-5-4-6-10/h10H,1-9H2,(H,14,17)
InChIKeyZFMRSYIGESSVBD-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.18
Rot. Bonds1

About 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione

3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione (PubChem CID 116658437) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione.

Molecular Properties

Compound Name3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione
PubChem CID116658437
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)NC(=O)N1C1CCC1
InChIInChI=1S/C13H20N2O2/c16-11-9-13(7-2-1-3-8-13)14-12(17)15(11)10-5-4-6-10/h10H,1-9H2,(H,14,17)
InChIKeyZFMRSYIGESSVBD-UHFFFAOYSA-N
XLogP2.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-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 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione?
The IUPAC name of 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione (CID 116658437) is 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione.
What is the SMILES notation for 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione?
The canonical SMILES for 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione is O=C1CC2(CCCCC2)NC(=O)N1C1CCC1.
What is the InChIKey of 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione?
The InChIKey is ZFMRSYIGESSVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c16-11-9-13(7-2-1-3-8-13)14-12(17)15(11)10-5-4-6-10/h10H,1-9H2,(H,14,17).
What are the key properties of 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione?
3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione has a molecular weight of 236.31 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione is sourced from PubChem (CID 116658437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).