2-methyl-2-azaspiro[4.5]decane-1,6-dione

C10H15NO2 — CID 121207625

IUPAC2-methyl-2-azaspiro[4.5]decane-1,6-dione
SMILESCN1CCC2(CCCCC2=O)C1=O
InChIInChI=1S/C10H15NO2/c1-11-7-6-10(9(11)13)5-3-2-4-8(10)12/h2-7H2,1H3
InChIKeyUWBKZVXKLJIDMF-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.98
Rot. Bonds

About 2-methyl-2-azaspiro[4.5]decane-1,6-dione

2-methyl-2-azaspiro[4.5]decane-1,6-dione (PubChem CID 121207625) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-methyl-2-azaspiro[4.5]decane-1,6-dione.

Molecular Properties

Compound Name2-methyl-2-azaspiro[4.5]decane-1,6-dione
PubChem CID121207625
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-methyl-2-azaspiro[4.5]decane-1,6-dione
SMILESCN1CCC2(CCCCC2=O)C1=O
InChIInChI=1S/C10H15NO2/c1-11-7-6-10(9(11)13)5-3-2-4-8(10)12/h2-7H2,1H3
InChIKeyUWBKZVXKLJIDMF-UHFFFAOYSA-N
XLogP0.98
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-azaspiro[4.5]decane-1,6-dione?
The IUPAC name of 2-methyl-2-azaspiro[4.5]decane-1,6-dione (CID 121207625) is 2-methyl-2-azaspiro[4.5]decane-1,6-dione.
What is the SMILES notation for 2-methyl-2-azaspiro[4.5]decane-1,6-dione?
The canonical SMILES for 2-methyl-2-azaspiro[4.5]decane-1,6-dione is CN1CCC2(CCCCC2=O)C1=O.
What is the InChIKey of 2-methyl-2-azaspiro[4.5]decane-1,6-dione?
The InChIKey is UWBKZVXKLJIDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-11-7-6-10(9(11)13)5-3-2-4-8(10)12/h2-7H2,1H3.
What are the key properties of 2-methyl-2-azaspiro[4.5]decane-1,6-dione?
2-methyl-2-azaspiro[4.5]decane-1,6-dione has a molecular weight of 181.23 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-azaspiro[4.5]decane-1,6-dione is sourced from PubChem (CID 121207625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).