8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane

C7H12FNO — CID 105428765

IUPAC8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane
SMILESCC1(F)C2CNCC1OC2
InChIInChI=1S/C7H12FNO/c1-7(8)5-2-9-3-6(7)10-4-5/h5-6,9H,2-4H2,1H3
InChIKeyAUOWTPQTLWLAHW-UHFFFAOYSA-N
MW145.18 g/mol
LogP0.33
Rot. Bonds

About 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane

8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane (PubChem CID 105428765) has the molecular formula C7H12FNO and a molecular weight of 145.18 g/mol. Its IUPAC name is 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane
PubChem CID105428765
Molecular FormulaC7H12FNO
Molecular Weight145.18 g/mol
Exact Mass145.09
IUPAC Name8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane
SMILESCC1(F)C2CNCC1OC2
InChIInChI=1S/C7H12FNO/c1-7(8)5-2-9-3-6(7)10-4-5/h5-6,9H,2-4H2,1H3
InChIKeyAUOWTPQTLWLAHW-UHFFFAOYSA-N
XLogP0.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane?
The IUPAC name of 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane (CID 105428765) is 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane.
What is the SMILES notation for 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane?
The canonical SMILES for 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane is CC1(F)C2CNCC1OC2.
What is the InChIKey of 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane?
The InChIKey is AUOWTPQTLWLAHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FNO/c1-7(8)5-2-9-3-6(7)10-4-5/h5-6,9H,2-4H2,1H3.
What are the key properties of 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane?
8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane has a molecular weight of 145.18 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-8-methyl-6-oxa-3-azabicyclo[3.2.1]octane is sourced from PubChem (CID 105428765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).