7-fluoro-2-oxa-7-azaspiro[3.4]octane

C6H10FNO — CID 177019648

IUPAC7-fluoro-2-oxa-7-azaspiro[3.4]octane
SMILESFN1CCC2(COC2)C1
InChIInChI=1S/C6H10FNO/c7-8-2-1-6(3-8)4-9-5-6/h1-5H2
InChIKeyGFJJDELBLUIGOZ-UHFFFAOYSA-N
MW131.15 g/mol
LogP0.59
Rot. Bonds

About 7-fluoro-2-oxa-7-azaspiro[3.4]octane

7-fluoro-2-oxa-7-azaspiro[3.4]octane (PubChem CID 177019648) has the molecular formula C6H10FNO and a molecular weight of 131.15 g/mol. Its IUPAC name is 7-fluoro-2-oxa-7-azaspiro[3.4]octane.

Molecular Properties

Compound Name7-fluoro-2-oxa-7-azaspiro[3.4]octane
PubChem CID177019648
Molecular FormulaC6H10FNO
Molecular Weight131.15 g/mol
Exact Mass131.07
IUPAC Name7-fluoro-2-oxa-7-azaspiro[3.4]octane
SMILESFN1CCC2(COC2)C1
InChIInChI=1S/C6H10FNO/c7-8-2-1-6(3-8)4-9-5-6/h1-5H2
InChIKeyGFJJDELBLUIGOZ-UHFFFAOYSA-N
XLogP0.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

Analyze 7-fluoro-2-oxa-7-azaspiro[3.4]octane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-oxa-7-azaspiro[3.4]octane?
The IUPAC name of 7-fluoro-2-oxa-7-azaspiro[3.4]octane (CID 177019648) is 7-fluoro-2-oxa-7-azaspiro[3.4]octane.
What is the SMILES notation for 7-fluoro-2-oxa-7-azaspiro[3.4]octane?
The canonical SMILES for 7-fluoro-2-oxa-7-azaspiro[3.4]octane is FN1CCC2(COC2)C1.
What is the InChIKey of 7-fluoro-2-oxa-7-azaspiro[3.4]octane?
The InChIKey is GFJJDELBLUIGOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FNO/c7-8-2-1-6(3-8)4-9-5-6/h1-5H2.
What are the key properties of 7-fluoro-2-oxa-7-azaspiro[3.4]octane?
7-fluoro-2-oxa-7-azaspiro[3.4]octane has a molecular weight of 131.15 g/mol, XLogP of 0.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-oxa-7-azaspiro[3.4]octane is sourced from PubChem (CID 177019648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).