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

C10H10FNO3 — CID 11106657

IUPAC6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C=C2F
InChIInChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-7(13)6-8(10)11/h2,4,6H,3,5H2,1H3
InChIKeyKSDWVSHSCMCLCP-UHFFFAOYSA-N
MW211.19 g/mol
LogP0.90
Rot. Bonds1

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

6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 11106657) has the molecular formula C10H10FNO3 and a molecular weight of 211.19 g/mol. Its IUPAC name is 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID11106657
Molecular FormulaC10H10FNO3
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Name6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C=C2F
InChIInChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-7(13)6-8(10)11/h2,4,6H,3,5H2,1H3
InChIKeyKSDWVSHSCMCLCP-UHFFFAOYSA-N
XLogP0.90
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.19
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 11106657) is 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is CON1C(=O)CCC12C=CC(=O)C=C2F.
What is the InChIKey of 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is KSDWVSHSCMCLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-7(13)6-8(10)11/h2,4,6H,3,5H2,1H3.
What are the key properties of 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione has a molecular weight of 211.19 g/mol, XLogP of 0.90, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 11106657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).