(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

C11H13NO3 — CID 125482402

IUPAC(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)[C@@H](C)CC12C=CC(=O)C=C2
InChIInChI=1S/C11H13NO3/c1-8-7-11(12(15-2)10(8)14)5-3-9(13)4-6-11/h3-6,8H,7H2,1-2H3/t8-/m0/s1
InChIKeySIJVDIOLZYMIHZ-QMMMGPOBSA-N
MW207.23 g/mol
LogP0.85
Rot. Bonds1

About (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione

(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 125482402) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID125482402
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)[C@@H](C)CC12C=CC(=O)C=C2
InChIInChI=1S/C11H13NO3/c1-8-7-11(12(15-2)10(8)14)5-3-9(13)4-6-11/h3-6,8H,7H2,1-2H3/t8-/m0/s1
InChIKeySIJVDIOLZYMIHZ-QMMMGPOBSA-N
XLogP0.85
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 ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione with MolForge

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Related Compounds

1-Azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 129877203
7-Fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11031120
6-Fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11106657
1-Methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11298476
(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-7,9-diene-2,6-dione
CID 134982796
6-Chloro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11020626
1-Methoxy-7-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11031019
7-Chloro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11746365
3,3-Diethyl-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 118963012
3-Methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 160071872
(4R,5S)-1-methoxy-4-methyl-6-propan-2-yl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 11425200
1-Methoxy-4,6-dimethyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 16115814

Frequently Asked Questions

What is the IUPAC name of (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 125482402) is (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is CON1C(=O)[C@@H](C)CC12C=CC(=O)C=C2.
What is the InChIKey of (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is SIJVDIOLZYMIHZ-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H13NO3/c1-8-7-11(12(15-2)10(8)14)5-3-9(13)4-6-11/h3-6,8H,7H2,1-2H3/t8-/m0/s1.
What are the key properties of (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
(3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione has a molecular weight of 207.23 g/mol, XLogP of 0.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-methoxy-3-methyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 125482402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).