(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane

C5H8FN — CID 66837540

IUPAC(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane
SMILESFC1[C@H]2CNC[C@@H]12
InChIInChI=1S/C5H8FN/c6-5-3-1-7-2-4(3)5/h3-5,7H,1-2H2/t3-,4+,5?
InChIKeyGZDUFGFBYSRRBS-NGQZWQHPSA-N
MW101.12 g/mol
LogP0.17
Rot. Bonds

About (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane

(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane (PubChem CID 66837540) has the molecular formula C5H8FN and a molecular weight of 101.12 g/mol. Its IUPAC name is (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane.

Molecular Properties

Compound Name(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane
PubChem CID66837540
Molecular FormulaC5H8FN
Molecular Weight101.12 g/mol
Exact Mass101.06
IUPAC Name(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane
SMILESFC1[C@H]2CNC[C@@H]12
InChIInChI=1S/C5H8FN/c6-5-3-1-7-2-4(3)5/h3-5,7H,1-2H2/t3-,4+,5?
InChIKeyGZDUFGFBYSRRBS-NGQZWQHPSA-N
XLogP0.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.12
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane?
The IUPAC name of (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane (CID 66837540) is (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane.
What is the SMILES notation for (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane?
The canonical SMILES for (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane is FC1[C@H]2CNC[C@@H]12.
What is the InChIKey of (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane?
The InChIKey is GZDUFGFBYSRRBS-NGQZWQHPSA-N. The full InChI is InChI=1S/C5H8FN/c6-5-3-1-7-2-4(3)5/h3-5,7H,1-2H2/t3-,4+,5?.
What are the key properties of (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane?
(1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane has a molecular weight of 101.12 g/mol, XLogP of 0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5S)-6-fluoro-3-azabicyclo[3.1.0]hexane is sourced from PubChem (CID 66837540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).