6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane

C5H11N3O2S — CID 114959300

IUPAC6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane
SMILESNS(=O)(=O)NC1C2CNCC21
InChIInChI=1S/C5H11N3O2S/c6-11(9,10)8-5-3-1-7-2-4(3)5/h3-5,7-8H,1-2H2,(H2,6,9,10)
InChIKeyICUGLFKCGSGEHI-UHFFFAOYSA-N
MW177.23 g/mol
LogP-2.00
Rot. Bonds2

About 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane

6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane (PubChem CID 114959300) has the molecular formula C5H11N3O2S and a molecular weight of 177.23 g/mol. Its IUPAC name is 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane.

Molecular Properties

Compound Name6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane
PubChem CID114959300
Molecular FormulaC5H11N3O2S
Molecular Weight177.23 g/mol
Exact Mass177.06
IUPAC Name6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane
SMILESNS(=O)(=O)NC1C2CNCC21
InChIInChI=1S/C5H11N3O2S/c6-11(9,10)8-5-3-1-7-2-4(3)5/h3-5,7-8H,1-2H2,(H2,6,9,10)
InChIKeyICUGLFKCGSGEHI-UHFFFAOYSA-N
XLogP-2.00
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 5-2.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane?
The IUPAC name of 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane (CID 114959300) is 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane.
What is the SMILES notation for 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane?
The canonical SMILES for 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane is NS(=O)(=O)NC1C2CNCC21.
What is the InChIKey of 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane?
The InChIKey is ICUGLFKCGSGEHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2S/c6-11(9,10)8-5-3-1-7-2-4(3)5/h3-5,7-8H,1-2H2,(H2,6,9,10).
What are the key properties of 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane?
6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane has a molecular weight of 177.23 g/mol, XLogP of -2.00, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(sulfamoylamino)-3-azabicyclo[3.1.0]hexane is sourced from PubChem (CID 114959300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).