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

C8H14FN — CID 68756270

IUPAC3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane
SMILESCC1(F)CC2CCC(C1)N2
InChIInChI=1S/C8H14FN/c1-8(9)4-6-2-3-7(5-8)10-6/h6-7,10H,2-5H2,1H3
InChIKeyFCHHXXVNHDDMJD-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.63
Rot. Bonds

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

3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane (PubChem CID 68756270) has the molecular formula C8H14FN and a molecular weight of 143.21 g/mol. Its IUPAC name is 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane
PubChem CID68756270
Molecular FormulaC8H14FN
Molecular Weight143.21 g/mol
Exact Mass143.11
IUPAC Name3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane
SMILESCC1(F)CC2CCC(C1)N2
InChIInChI=1S/C8H14FN/c1-8(9)4-6-2-3-7(5-8)10-6/h6-7,10H,2-5H2,1H3
InChIKeyFCHHXXVNHDDMJD-UHFFFAOYSA-N
XLogP1.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane?
The IUPAC name of 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane (CID 68756270) is 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane is CC1(F)CC2CCC(C1)N2.
What is the InChIKey of 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane?
The InChIKey is FCHHXXVNHDDMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-8(9)4-6-2-3-7(5-8)10-6/h6-7,10H,2-5H2,1H3.
What are the key properties of 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane?
3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane has a molecular weight of 143.21 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-methyl-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 68756270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).