5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide

C8H7F4NO4S — CID 106295742

IUPAC5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide
SMILESO=Cc1ccc(S(=O)(=O)NCC(F)(F)C(F)F)o1
InChIInChI=1S/C8H7F4NO4S/c9-7(10)8(11,12)4-13-18(15,16)6-2-1-5(3-14)17-6/h1-3,7,13H,4H2
InChIKeyYEMSYQGEXTUYIH-UHFFFAOYSA-N
MW289.21 g/mol
LogP1.27
Rot. Bonds6

About 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide

5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide (PubChem CID 106295742) has the molecular formula C8H7F4NO4S and a molecular weight of 289.21 g/mol. Its IUPAC name is 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide
PubChem CID106295742
Molecular FormulaC8H7F4NO4S
Molecular Weight289.21 g/mol
Exact Mass289.00
IUPAC Name5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide
SMILESO=Cc1ccc(S(=O)(=O)NCC(F)(F)C(F)F)o1
InChIInChI=1S/C8H7F4NO4S/c9-7(10)8(11,12)4-13-18(15,16)6-2-1-5(3-14)17-6/h1-3,7,13H,4H2
InChIKeyYEMSYQGEXTUYIH-UHFFFAOYSA-N
XLogP1.27
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.21
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,2-difluoro-3-hydroxypropyl)-5-methylfuran-2-sulfonamide
CID 136531967
5-methyl-N-[(2S)-4,4,4-trifluoro-1-hydroxybutan-2-yl]furan-2-sulfonamide
CID 164632959
5-formyl-N-(trifluoromethylsulfonyl)furan-2-sulfonamide
CID 88186714
N-(5-formylfuran-2-yl)sulfonylsulfamoyl fluoride
CID 88187486
5-(Trifluoromethyl)furan-3-sulfonamide
CID 123341484
2-(Trifluoromethyl)furan-3-sulfonamide
CID 141148668
5-(Difluoromethyl)furan-2-sulfonamide
CID 165885973
Lithium 5-[(3,3-difluorocyclobutyl)sulfamoyl]furan-2-carboxylate
CID 169084093
5-methyl-N-(2,2,2-trifluoroethyl)furan-2-sulfonamide
CID 169087413
5-ethenyl-N-(trifluoromethylsulfonyl)furan-2-sulfonamide
CID 170202889
5-methyl-N-(1,2,2-trifluoroethyl)furan-2-sulfonamide
CID 175455461
5-(2,2,2-Trifluoroethylsulfamoyl)furan-2-carboxylic acid
CID 29077583

Frequently Asked Questions

What is the IUPAC name of 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide?
The IUPAC name of 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide (CID 106295742) is 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide.
What is the SMILES notation for 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide?
The canonical SMILES for 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide is O=Cc1ccc(S(=O)(=O)NCC(F)(F)C(F)F)o1.
What is the InChIKey of 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide?
The InChIKey is YEMSYQGEXTUYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F4NO4S/c9-7(10)8(11,12)4-13-18(15,16)6-2-1-5(3-14)17-6/h1-3,7,13H,4H2.
What are the key properties of 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide?
5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide has a molecular weight of 289.21 g/mol, XLogP of 1.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-formyl-N-(2,2,3,3-tetrafluoropropyl)furan-2-sulfonamide is sourced from PubChem (CID 106295742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).