1,1,2,2,2-pentafluoroethanesulfonamide

C2H2F5NO2S — CID 11252905

IUPAC1,1,2,2,2-pentafluoroethanesulfonamide
SMILESNS(=O)(=O)C(F)(F)C(F)(F)F
InChIInChI=1S/C2H2F5NO2S/c3-1(4,5)2(6,7)11(8,9)10/h(H2,8,9,10)
InChIKeyQDUKVMNUAQTMQW-UHFFFAOYSA-N
MW199.10 g/mol
LogP0.43
Rot. Bonds1

About 1,1,2,2,2-pentafluoroethanesulfonamide

1,1,2,2,2-pentafluoroethanesulfonamide (PubChem CID 11252905) has the molecular formula C2H2F5NO2S and a molecular weight of 199.10 g/mol. Its IUPAC name is 1,1,2,2,2-pentafluoroethanesulfonamide.

Molecular Properties

Compound Name1,1,2,2,2-pentafluoroethanesulfonamide
PubChem CID11252905
Molecular FormulaC2H2F5NO2S
Molecular Weight199.10 g/mol
Exact Mass198.97
IUPAC Name1,1,2,2,2-pentafluoroethanesulfonamide
SMILESNS(=O)(=O)C(F)(F)C(F)(F)F
InChIInChI=1S/C2H2F5NO2S/c3-1(4,5)2(6,7)11(8,9)10/h(H2,8,9,10)
InChIKeyQDUKVMNUAQTMQW-UHFFFAOYSA-N
XLogP0.43
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.10
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Perfluorobutane sulfonamide
CID 10958205
Heptafluoropropane-1-sulfonamide
CID 21692167
Ethanesulfonamide, 1,1,2,2,2-pentafluoro-N-[(pentafluoroethyl)sulfonyl]-
CID 2779028
Perfluoropentane sulfonamide
CID 87793813
Sodium perfluorobutane sulfonamide
CID 10958204
Potassium (perfluorobutanesulfonyl)azanide
CID 141294936
Pentafluoroethylsulfonyl(trifluoromethylsulfonyl)amine
CID 57680057
1,1,1,2,3,3,3-Heptafluoropropane-2-sulfonamide
CID 12522024
Fluoro 1,1,2,2,2-pentafluoroethanesulfonate
CID 17764680
N,1,1,2,2,3,3,4,4,4-decafluorobutane-1-sulfonamide
CID 22033855
Pentafluoroethanesulfonate
CID 22062497
N-(1,1,2,2,2-pentafluoroethylsulfonyl)sulfamoyl chloride
CID 46837539

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,2-pentafluoroethanesulfonamide?
The IUPAC name of 1,1,2,2,2-pentafluoroethanesulfonamide (CID 11252905) is 1,1,2,2,2-pentafluoroethanesulfonamide.
What is the SMILES notation for 1,1,2,2,2-pentafluoroethanesulfonamide?
The canonical SMILES for 1,1,2,2,2-pentafluoroethanesulfonamide is NS(=O)(=O)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,2,2,2-pentafluoroethanesulfonamide?
The InChIKey is QDUKVMNUAQTMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2F5NO2S/c3-1(4,5)2(6,7)11(8,9)10/h(H2,8,9,10).
What are the key properties of 1,1,2,2,2-pentafluoroethanesulfonamide?
1,1,2,2,2-pentafluoroethanesulfonamide has a molecular weight of 199.10 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,2-pentafluoroethanesulfonamide is sourced from PubChem (CID 11252905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).