2-methyl-2-azaspiro[4.5]dec-7-en-1-one

C10H15NO — CID 71421677

IUPAC2-methyl-2-azaspiro[4.5]dec-7-en-1-one
SMILESCN1CCC2(CC=CCC2)C1=O
InChIInChI=1S/C10H15NO/c1-11-8-7-10(9(11)12)5-3-2-4-6-10/h2-3H,4-8H2,1H3
InChIKeyCNZQPUBXMSLSRP-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.58
Rot. Bonds

About 2-methyl-2-azaspiro[4.5]dec-7-en-1-one

2-methyl-2-azaspiro[4.5]dec-7-en-1-one (PubChem CID 71421677) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-methyl-2-azaspiro[4.5]dec-7-en-1-one.

Molecular Properties

Compound Name2-methyl-2-azaspiro[4.5]dec-7-en-1-one
PubChem CID71421677
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-methyl-2-azaspiro[4.5]dec-7-en-1-one
SMILESCN1CCC2(CC=CCC2)C1=O
InChIInChI=1S/C10H15NO/c1-11-8-7-10(9(11)12)5-3-2-4-6-10/h2-3H,4-8H2,1H3
InChIKeyCNZQPUBXMSLSRP-UHFFFAOYSA-N
XLogP1.58
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-azaspiro[4.5]dec-7-en-1-one?
The IUPAC name of 2-methyl-2-azaspiro[4.5]dec-7-en-1-one (CID 71421677) is 2-methyl-2-azaspiro[4.5]dec-7-en-1-one.
What is the SMILES notation for 2-methyl-2-azaspiro[4.5]dec-7-en-1-one?
The canonical SMILES for 2-methyl-2-azaspiro[4.5]dec-7-en-1-one is CN1CCC2(CC=CCC2)C1=O.
What is the InChIKey of 2-methyl-2-azaspiro[4.5]dec-7-en-1-one?
The InChIKey is CNZQPUBXMSLSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-11-8-7-10(9(11)12)5-3-2-4-6-10/h2-3H,4-8H2,1H3.
What are the key properties of 2-methyl-2-azaspiro[4.5]dec-7-en-1-one?
2-methyl-2-azaspiro[4.5]dec-7-en-1-one has a molecular weight of 165.24 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-azaspiro[4.5]dec-7-en-1-one is sourced from PubChem (CID 71421677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).