2-[2,2-difluoroethyl(sulfamoyl)amino]propane

C5H12F2N2O2S — CID 167049037

IUPAC2-[2,2-difluoroethyl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(F)F)S(N)(=O)=O
InChIInChI=1S/C5H12F2N2O2S/c1-4(2)9(3-5(6)7)12(8,10)11/h4-5H,3H2,1-2H3,(H2,8,10,11)
InChIKeyLBNMPDWWNGGOJZ-UHFFFAOYSA-N
MW202.23 g/mol
LogP0.17
Rot. Bonds4

About 2-[2,2-difluoroethyl(sulfamoyl)amino]propane

2-[2,2-difluoroethyl(sulfamoyl)amino]propane (PubChem CID 167049037) has the molecular formula C5H12F2N2O2S and a molecular weight of 202.23 g/mol. Its IUPAC name is 2-[2,2-difluoroethyl(sulfamoyl)amino]propane.

Molecular Properties

Compound Name2-[2,2-difluoroethyl(sulfamoyl)amino]propane
PubChem CID167049037
Molecular FormulaC5H12F2N2O2S
Molecular Weight202.23 g/mol
Exact Mass202.06
IUPAC Name2-[2,2-difluoroethyl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(F)F)S(N)(=O)=O
InChIInChI=1S/C5H12F2N2O2S/c1-4(2)9(3-5(6)7)12(8,10)11/h4-5H,3H2,1-2H3,(H2,8,10,11)
InChIKeyLBNMPDWWNGGOJZ-UHFFFAOYSA-N
XLogP0.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.23
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2,2-difluoroethyl(sulfamoyl)amino]propane?
The IUPAC name of 2-[2,2-difluoroethyl(sulfamoyl)amino]propane (CID 167049037) is 2-[2,2-difluoroethyl(sulfamoyl)amino]propane.
What is the SMILES notation for 2-[2,2-difluoroethyl(sulfamoyl)amino]propane?
The canonical SMILES for 2-[2,2-difluoroethyl(sulfamoyl)amino]propane is CC(C)N(CC(F)F)S(N)(=O)=O.
What is the InChIKey of 2-[2,2-difluoroethyl(sulfamoyl)amino]propane?
The InChIKey is LBNMPDWWNGGOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12F2N2O2S/c1-4(2)9(3-5(6)7)12(8,10)11/h4-5H,3H2,1-2H3,(H2,8,10,11).
What are the key properties of 2-[2,2-difluoroethyl(sulfamoyl)amino]propane?
2-[2,2-difluoroethyl(sulfamoyl)amino]propane has a molecular weight of 202.23 g/mol, XLogP of 0.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-difluoroethyl(sulfamoyl)amino]propane is sourced from PubChem (CID 167049037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).