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

C11H13NO4 — CID 150187772

IUPAC7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCOC1=CC2(C=C(OC)C1=O)CCC(=O)N2
InChIInChI=1S/C11H13NO4/c1-15-7-5-11(4-3-9(13)12-11)6-8(16-2)10(7)14/h5-6H,3-4H2,1-2H3,(H,12,13)
InChIKeyFMUDRWSZSZDXDZ-UHFFFAOYSA-N
MW223.23 g/mol
LogP0.28
Rot. Bonds2

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

7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 150187772) has the molecular formula C11H13NO4 and a molecular weight of 223.23 g/mol. Its IUPAC name is 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID150187772
Molecular FormulaC11H13NO4
Molecular Weight223.23 g/mol
Exact Mass223.08
IUPAC Name7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCOC1=CC2(C=C(OC)C1=O)CCC(=O)N2
InChIInChI=1S/C11H13NO4/c1-15-7-5-11(4-3-9(13)12-11)6-8(16-2)10(7)14/h5-6H,3-4H2,1-2H3,(H,12,13)
InChIKeyFMUDRWSZSZDXDZ-UHFFFAOYSA-N
XLogP0.28
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-Methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 139312600
1,7-Dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 101401535

Frequently Asked Questions

What is the IUPAC name of 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 150187772) is 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is COC1=CC2(C=C(OC)C1=O)CCC(=O)N2.
What is the InChIKey of 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is FMUDRWSZSZDXDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO4/c1-15-7-5-11(4-3-9(13)12-11)6-8(16-2)10(7)14/h5-6H,3-4H2,1-2H3,(H,12,13).
What are the key properties of 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione has a molecular weight of 223.23 g/mol, XLogP of 0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 150187772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).