6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane

C7H11F2NO — CID 137453683

IUPAC6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane
SMILESCN1C2COCC1C(F)C2F
InChIInChI=1S/C7H11F2NO/c1-10-4-2-11-3-5(10)7(9)6(4)8/h4-7H,2-3H2,1H3
InChIKeyUWJGFBRPURJPMJ-UHFFFAOYSA-N
MW163.17 g/mol
LogP0.38
Rot. Bonds

About 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane

6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane (PubChem CID 137453683) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane
PubChem CID137453683
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane
SMILESCN1C2COCC1C(F)C2F
InChIInChI=1S/C7H11F2NO/c1-10-4-2-11-3-5(10)7(9)6(4)8/h4-7H,2-3H2,1H3
InChIKeyUWJGFBRPURJPMJ-UHFFFAOYSA-N
XLogP0.38
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]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 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane?
The IUPAC name of 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane (CID 137453683) is 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane is CN1C2COCC1C(F)C2F.
What is the InChIKey of 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane?
The InChIKey is UWJGFBRPURJPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c1-10-4-2-11-3-5(10)7(9)6(4)8/h4-7H,2-3H2,1H3.
What are the key properties of 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane?
6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane has a molecular weight of 163.17 g/mol, XLogP of 0.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 137453683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).