2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane

C6H14F2N2O2S — CID 167049012

IUPAC2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(C)(F)F)S(N)(=O)=O
InChIInChI=1S/C6H14F2N2O2S/c1-5(2)10(13(9,11)12)4-6(3,7)8/h5H,4H2,1-3H3,(H2,9,11,12)
InChIKeyONDAASXHECKMPY-UHFFFAOYSA-N
MW216.25 g/mol
LogP0.56
Rot. Bonds4

About 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane

2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane (PubChem CID 167049012) has the molecular formula C6H14F2N2O2S and a molecular weight of 216.25 g/mol. Its IUPAC name is 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane.

Molecular Properties

Compound Name2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane
PubChem CID167049012
Molecular FormulaC6H14F2N2O2S
Molecular Weight216.25 g/mol
Exact Mass216.07
IUPAC Name2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane
SMILESCC(C)N(CC(C)(F)F)S(N)(=O)=O
InChIInChI=1S/C6H14F2N2O2S/c1-5(2)10(13(9,11)12)4-6(3,7)8/h5H,4H2,1-3H3,(H2,9,11,12)
InChIKeyONDAASXHECKMPY-UHFFFAOYSA-N
XLogP0.56
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.25
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane?
The IUPAC name of 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane (CID 167049012) is 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane.
What is the SMILES notation for 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane?
The canonical SMILES for 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane is CC(C)N(CC(C)(F)F)S(N)(=O)=O.
What is the InChIKey of 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane?
The InChIKey is ONDAASXHECKMPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14F2N2O2S/c1-5(2)10(13(9,11)12)4-6(3,7)8/h5H,4H2,1-3H3,(H2,9,11,12).
What are the key properties of 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane?
2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane has a molecular weight of 216.25 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-[propan-2-yl(sulfamoyl)amino]propane is sourced from PubChem (CID 167049012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).