2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane

C8H19F2N3O2S — CID 107493859

IUPAC2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane
SMILESCC(C)(C)NS(=O)(=O)N(CCN)CC(F)F
InChIInChI=1S/C8H19F2N3O2S/c1-8(2,3)12-16(14,15)13(5-4-11)6-7(9)10/h7,12H,4-6,11H2,1-3H3
InChIKeyFFDNZNFFPURZKI-UHFFFAOYSA-N
MW259.32 g/mol
LogP0.15
Rot. Bonds6

About 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane

2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane (PubChem CID 107493859) has the molecular formula C8H19F2N3O2S and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane.

Molecular Properties

Compound Name2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane
PubChem CID107493859
Molecular FormulaC8H19F2N3O2S
Molecular Weight259.32 g/mol
Exact Mass259.12
IUPAC Name2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane
SMILESCC(C)(C)NS(=O)(=O)N(CCN)CC(F)F
InChIInChI=1S/C8H19F2N3O2S/c1-8(2,3)12-16(14,15)13(5-4-11)6-7(9)10/h7,12H,4-6,11H2,1-3H3
InChIKeyFFDNZNFFPURZKI-UHFFFAOYSA-N
XLogP0.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane?
The IUPAC name of 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane (CID 107493859) is 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane.
What is the SMILES notation for 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane?
The canonical SMILES for 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane is CC(C)(C)NS(=O)(=O)N(CCN)CC(F)F.
What is the InChIKey of 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane?
The InChIKey is FFDNZNFFPURZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19F2N3O2S/c1-8(2,3)12-16(14,15)13(5-4-11)6-7(9)10/h7,12H,4-6,11H2,1-3H3.
What are the key properties of 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane?
2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane has a molecular weight of 259.32 g/mol, XLogP of 0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-aminoethyl(2,2-difluoroethyl)sulfamoyl]amino]-2-methylpropane is sourced from PubChem (CID 107493859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).