3-azaspiro[5.5]undecane-2,4-dione

C10H15NO2 — CID 14324

IUPAC3-azaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)CC(=O)N1
InChIInChI=1S/C10H15NO2/c12-8-6-10(7-9(13)11-8)4-2-1-3-5-10/h1-7H2,(H,11,12,13)
InChIKeyFNIPRNMPSXNBDI-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.37
Rot. Bonds

About 3-azaspiro[5.5]undecane-2,4-dione

3-azaspiro[5.5]undecane-2,4-dione (PubChem CID 14324) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 3-azaspiro[5.5]undecane-2,4-dione.

Molecular Properties

Compound Name3-azaspiro[5.5]undecane-2,4-dione
PubChem CID14324
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name3-azaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)CC(=O)N1
InChIInChI=1S/C10H15NO2/c12-8-6-10(7-9(13)11-8)4-2-1-3-5-10/h1-7H2,(H,11,12,13)
InChIKeyFNIPRNMPSXNBDI-UHFFFAOYSA-N
XLogP1.37
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-azaspiro[5.5]undecane-2,4-dione?
The IUPAC name of 3-azaspiro[5.5]undecane-2,4-dione (CID 14324) is 3-azaspiro[5.5]undecane-2,4-dione.
What is the SMILES notation for 3-azaspiro[5.5]undecane-2,4-dione?
The canonical SMILES for 3-azaspiro[5.5]undecane-2,4-dione is O=C1CC2(CCCCC2)CC(=O)N1.
What is the InChIKey of 3-azaspiro[5.5]undecane-2,4-dione?
The InChIKey is FNIPRNMPSXNBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c12-8-6-10(7-9(13)11-8)4-2-1-3-5-10/h1-7H2,(H,11,12,13).
What are the key properties of 3-azaspiro[5.5]undecane-2,4-dione?
3-azaspiro[5.5]undecane-2,4-dione has a molecular weight of 181.23 g/mol, XLogP of 1.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-azaspiro[5.5]undecane-2,4-dione is sourced from PubChem (CID 14324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).