1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane

C3H8F2N2O2S — CID 88598102

IUPAC1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane
SMILESCN(CC(F)F)S(N)(=O)=O
InChIInChI=1S/C3H8F2N2O2S/c1-7(2-3(4)5)10(6,8)9/h3H,2H2,1H3,(H2,6,8,9)
InChIKeyOOTKSEUQHGQKKC-UHFFFAOYSA-N
MW174.17 g/mol
LogP-0.61
Rot. Bonds3

About 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane

1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane (PubChem CID 88598102) has the molecular formula C3H8F2N2O2S and a molecular weight of 174.17 g/mol. Its IUPAC name is 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane.

Molecular Properties

Compound Name1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane
PubChem CID88598102
Molecular FormulaC3H8F2N2O2S
Molecular Weight174.17 g/mol
Exact Mass174.03
IUPAC Name1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane
SMILESCN(CC(F)F)S(N)(=O)=O
InChIInChI=1S/C3H8F2N2O2S/c1-7(2-3(4)5)10(6,8)9/h3H,2H2,1H3,(H2,6,8,9)
InChIKeyOOTKSEUQHGQKKC-UHFFFAOYSA-N
XLogP-0.61
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.17
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane?
The IUPAC name of 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane (CID 88598102) is 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane.
What is the SMILES notation for 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane?
The canonical SMILES for 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane is CN(CC(F)F)S(N)(=O)=O.
What is the InChIKey of 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane?
The InChIKey is OOTKSEUQHGQKKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8F2N2O2S/c1-7(2-3(4)5)10(6,8)9/h3H,2H2,1H3,(H2,6,8,9).
What are the key properties of 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane?
1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane has a molecular weight of 174.17 g/mol, XLogP of -0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2-[methyl(sulfamoyl)amino]ethane is sourced from PubChem (CID 88598102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).