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

C10H10FNO3 — CID 11031120

IUPAC7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C(F)=C2
InChIInChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-8(13)7(11)6-10/h2,4,6H,3,5H2,1H3
InChIKeySCBXIDLGOGIXNQ-UHFFFAOYSA-N
MW211.19 g/mol
LogP0.90
Rot. Bonds1

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

7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (PubChem CID 11031120) has the molecular formula C10H10FNO3 and a molecular weight of 211.19 g/mol. Its IUPAC name is 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.

Molecular Properties

Compound Name7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
PubChem CID11031120
Molecular FormulaC10H10FNO3
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Name7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
SMILESCON1C(=O)CCC12C=CC(=O)C(F)=C2
InChIInChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-8(13)7(11)6-10/h2,4,6H,3,5H2,1H3
InChIKeySCBXIDLGOGIXNQ-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_one_hal(17)', 'substructure': 'N/A'}

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Related Compounds

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
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
1-Methoxy-4,6-dimethyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 16115814
7-Acetyl-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 49818310
(4R,5S)-1-methoxy-4,6-dimethyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 101235398
(3S,5R)-1-methoxy-3,6-dimethyl-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 101235400
1,7-Dimethoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 101401535
7-Bromo-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione
CID 102184843

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The IUPAC name of 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione (CID 11031120) is 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione.
What is the SMILES notation for 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The canonical SMILES for 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is CON1C(=O)CCC12C=CC(=O)C(F)=C2.
What is the InChIKey of 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
The InChIKey is SCBXIDLGOGIXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3/c1-15-12-9(14)3-5-10(12)4-2-8(13)7(11)6-10/h2,4,6H,3,5H2,1H3.
What are the key properties of 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione?
7-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 7-fluoro-1-methoxy-1-azaspiro[4.5]deca-6,9-diene-2,8-dione is sourced from PubChem (CID 11031120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).