2-amino-1,1,2,2-tetrafluoroethanesulfonamide

C2H4F4N2O2S — CID 87658444

IUPAC2-amino-1,1,2,2-tetrafluoroethanesulfonamide
SMILESNC(F)(F)C(F)(F)S(N)(=O)=O
InChIInChI=1S/C2H4F4N2O2S/c3-1(4,7)2(5,6)11(8,9)10/h7H2,(H2,8,9,10)
InChIKeyUETGYLMLJNEYST-UHFFFAOYSA-N
MW196.12 g/mol
LogP-0.58
Rot. Bonds2

About 2-amino-1,1,2,2-tetrafluoroethanesulfonamide

2-amino-1,1,2,2-tetrafluoroethanesulfonamide (PubChem CID 87658444) has the molecular formula C2H4F4N2O2S and a molecular weight of 196.12 g/mol. Its IUPAC name is 2-amino-1,1,2,2-tetrafluoroethanesulfonamide.

Molecular Properties

Compound Name2-amino-1,1,2,2-tetrafluoroethanesulfonamide
PubChem CID87658444
Molecular FormulaC2H4F4N2O2S
Molecular Weight196.12 g/mol
Exact Mass195.99
IUPAC Name2-amino-1,1,2,2-tetrafluoroethanesulfonamide
SMILESNC(F)(F)C(F)(F)S(N)(=O)=O
InChIInChI=1S/C2H4F4N2O2S/c3-1(4,7)2(5,6)11(8,9)10/h7H2,(H2,8,9,10)
InChIKeyUETGYLMLJNEYST-UHFFFAOYSA-N
XLogP-0.58
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.12
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1,1,2,2-tetrafluoroethanesulfonamide?
The IUPAC name of 2-amino-1,1,2,2-tetrafluoroethanesulfonamide (CID 87658444) is 2-amino-1,1,2,2-tetrafluoroethanesulfonamide.
What is the SMILES notation for 2-amino-1,1,2,2-tetrafluoroethanesulfonamide?
The canonical SMILES for 2-amino-1,1,2,2-tetrafluoroethanesulfonamide is NC(F)(F)C(F)(F)S(N)(=O)=O.
What is the InChIKey of 2-amino-1,1,2,2-tetrafluoroethanesulfonamide?
The InChIKey is UETGYLMLJNEYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4F4N2O2S/c3-1(4,7)2(5,6)11(8,9)10/h7H2,(H2,8,9,10).
What are the key properties of 2-amino-1,1,2,2-tetrafluoroethanesulfonamide?
2-amino-1,1,2,2-tetrafluoroethanesulfonamide has a molecular weight of 196.12 g/mol, XLogP of -0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1,1,2,2-tetrafluoroethanesulfonamide is sourced from PubChem (CID 87658444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).