1-azaspiro[4.5]deca-6,9-dien-2-one

C9H11NO — CID 152560812

IUPAC1-azaspiro[4.5]deca-6,9-dien-2-one
SMILESO=C1CCC2(C=CCC=C2)N1
InChIInChI=1S/C9H11NO/c11-8-4-7-9(10-8)5-2-1-3-6-9/h2-3,5-6H,1,4,7H2,(H,10,11)
InChIKeyYPLMHKHMHSAQJY-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.15
Rot. Bonds

About 1-azaspiro[4.5]deca-6,9-dien-2-one

1-azaspiro[4.5]deca-6,9-dien-2-one (PubChem CID 152560812) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 1-azaspiro[4.5]deca-6,9-dien-2-one.

Molecular Properties

Compound Name1-azaspiro[4.5]deca-6,9-dien-2-one
PubChem CID152560812
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name1-azaspiro[4.5]deca-6,9-dien-2-one
SMILESO=C1CCC2(C=CCC=C2)N1
InChIInChI=1S/C9H11NO/c11-8-4-7-9(10-8)5-2-1-3-6-9/h2-3,5-6H,1,4,7H2,(H,10,11)
InChIKeyYPLMHKHMHSAQJY-UHFFFAOYSA-N
XLogP1.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4,6-Trimethyl-2-azabicyclo[3.2.0]hept-6-en-3-one
CID 282171
1-Azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 129877203
1-Azaspiro[4.4]non-6-EN-2-one
CID 23584432
11-Azatricyclo[4.4.3.01,6]trideca-2,4,7,9-tetraen-12-one
CID 134973656
5,5-Bis(prop-2-enyl)pyrrolidin-2-one
CID 138965083
5-Ethenyl-5-methylpyrrolidin-2-one
CID 298595
4,6,6-Tris(prop-2-enyl)-1,3-dihydropyridin-2-one
CID 70519383
8-Methyl-1-azaspiro[4.5]dec-6-en-2-one
CID 90967215
9-Methyl-1-azaspiro[4.5]deca-6,8-dien-2-one
CID 91160729
5-Methyl-5-penta-2,4-dienylpyrrolidin-2-one
CID 91564398
1-Azaspiro[4.5]dec-6-en-2-one
CID 101440491
5,5-Bis(ethenyl)pyrrolidin-2-one
CID 118696195

Frequently Asked Questions

What is the IUPAC name of 1-azaspiro[4.5]deca-6,9-dien-2-one?
The IUPAC name of 1-azaspiro[4.5]deca-6,9-dien-2-one (CID 152560812) is 1-azaspiro[4.5]deca-6,9-dien-2-one.
What is the SMILES notation for 1-azaspiro[4.5]deca-6,9-dien-2-one?
The canonical SMILES for 1-azaspiro[4.5]deca-6,9-dien-2-one is O=C1CCC2(C=CCC=C2)N1.
What is the InChIKey of 1-azaspiro[4.5]deca-6,9-dien-2-one?
The InChIKey is YPLMHKHMHSAQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c11-8-4-7-9(10-8)5-2-1-3-6-9/h2-3,5-6H,1,4,7H2,(H,10,11).
What are the key properties of 1-azaspiro[4.5]deca-6,9-dien-2-one?
1-azaspiro[4.5]deca-6,9-dien-2-one has a molecular weight of 149.19 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azaspiro[4.5]deca-6,9-dien-2-one is sourced from PubChem (CID 152560812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).