1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione

C12H15NO3 — CID 11736173

IUPAC1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione
SMILESCON1C(=O)CCCC12C=CC(=O)C(C)=C2
InChIInChI=1S/C12H15NO3/c1-9-8-12(7-5-10(9)14)6-3-4-11(15)13(12)16-2/h5,7-8H,3-4,6H2,1-2H3
InChIKeyALXWQPHXNHJUEK-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.38
Rot. Bonds1

About 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione

1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione (PubChem CID 11736173) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione.

Molecular Properties

Compound Name1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione
PubChem CID11736173
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione
SMILESCON1C(=O)CCCC12C=CC(=O)C(C)=C2
InChIInChI=1S/C12H15NO3/c1-9-8-12(7-5-10(9)14)6-3-4-11(15)13(12)16-2/h5,7-8H,3-4,6H2,1-2H3
InChIKeyALXWQPHXNHJUEK-UHFFFAOYSA-N
XLogP1.38
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methoxy-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione
CID 13709973
(5R,6S)-1-methoxy-5,11-dimethyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione
CID 11447683

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione?
The IUPAC name of 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione (CID 11736173) is 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione.
What is the SMILES notation for 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione?
The canonical SMILES for 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione is CON1C(=O)CCCC12C=CC(=O)C(C)=C2.
What is the InChIKey of 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione?
The InChIKey is ALXWQPHXNHJUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-9-8-12(7-5-10(9)14)6-3-4-11(15)13(12)16-2/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione?
1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione has a molecular weight of 221.26 g/mol, XLogP of 1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-10-methyl-1-azaspiro[5.5]undeca-7,10-diene-2,9-dione is sourced from PubChem (CID 11736173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).