1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

C11H13NO3 — CID 11031019

IUPAC1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C(C)=C2
InChIInChI=1S/C11H13NO3/c1-8-7-11(5-3-9(8)13)6-4-10(14)12(11)15-2/h3,5,7H,4,6H2,1-2H3
InChIKeyYPYJPIDRILCKBJ-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.99
Rot. Bonds1

About 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 11031019) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID11031019
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C(C)=C2
InChIInChI=1S/C11H13NO3/c1-8-7-11(5-3-9(8)13)6-4-10(14)12(11)15-2/h3,5,7H,4,6H2,1-2H3
InChIKeyYPYJPIDRILCKBJ-UHFFFAOYSA-N
XLogP0.99
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 11031019) is 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is CON1C(=O)CCC12C=CC(=O)C(C)=C2.
What is the InChIKey of 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is YPYJPIDRILCKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-8-7-11(5-3-9(8)13)6-4-10(14)12(11)15-2/h3,5,7H,4,6H2,1-2H3.
What are the key properties of 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione has a molecular weight of 207.23 g/mol, XLogP of 0.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 11031019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).