1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide

C5H5F8NO3S — CID 14928166

IUPAC1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide
SMILESCNS(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)F
InChIInChI=1S/C5H5F8NO3S/c1-14-18(15,16)5(12,13)4(10,11)17-3(8,9)2(6)7/h2,14H,1H3
InChIKeyGARAZBZLGDLXHL-UHFFFAOYSA-N
MW311.15 g/mol
LogP1.60
Rot. Bonds6

About 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide

1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide (PubChem CID 14928166) has the molecular formula C5H5F8NO3S and a molecular weight of 311.15 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide
PubChem CID14928166
Molecular FormulaC5H5F8NO3S
Molecular Weight311.15 g/mol
Exact Mass310.99
IUPAC Name1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide
SMILESCNS(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)F
InChIInChI=1S/C5H5F8NO3S/c1-14-18(15,16)5(12,13)4(10,11)17-3(8,9)2(6)7/h2,14H,1H3
InChIKeyGARAZBZLGDLXHL-UHFFFAOYSA-N
XLogP1.60
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.15
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide?
The IUPAC name of 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide (CID 14928166) is 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide.
What is the SMILES notation for 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide?
The canonical SMILES for 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide is CNS(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide?
The InChIKey is GARAZBZLGDLXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F8NO3S/c1-14-18(15,16)5(12,13)4(10,11)17-3(8,9)2(6)7/h2,14H,1H3.
What are the key properties of 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide?
1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide has a molecular weight of 311.15 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-N-methyl-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonamide is sourced from PubChem (CID 14928166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).