N-fluoro-4-thiophen-2-ylbenzenesulfonamide

C10H8FNO2S2 — CID 87730443

IUPACN-fluoro-4-thiophen-2-ylbenzenesulfonamide
SMILESO=S(=O)(NF)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C10H8FNO2S2/c11-12-16(13,14)9-5-3-8(4-6-9)10-2-1-7-15-10/h1-7,12H
InChIKeyHFVXDAKGNHUOQW-UHFFFAOYSA-N
MW257.31 g/mol
LogP2.58
Rot. Bonds3

About N-fluoro-4-thiophen-2-ylbenzenesulfonamide

N-fluoro-4-thiophen-2-ylbenzenesulfonamide (PubChem CID 87730443) has the molecular formula C10H8FNO2S2 and a molecular weight of 257.31 g/mol. Its IUPAC name is N-fluoro-4-thiophen-2-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-fluoro-4-thiophen-2-ylbenzenesulfonamide
PubChem CID87730443
Molecular FormulaC10H8FNO2S2
Molecular Weight257.31 g/mol
Exact Mass257.00
IUPAC NameN-fluoro-4-thiophen-2-ylbenzenesulfonamide
SMILESO=S(=O)(NF)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C10H8FNO2S2/c11-12-16(13,14)9-5-3-8(4-6-9)10-2-1-7-15-10/h1-7,12H
InChIKeyHFVXDAKGNHUOQW-UHFFFAOYSA-N
XLogP2.58
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-fluorothiophene-2-sulfonamide
CID 175398216
N-(pyridin-3-ylmethyl)-4-thiophen-2-ylbenzenesulfonamide
CID 141000174
S-[2-oxo-2-[4-[(4-thiophen-2-ylphenyl)sulfonylamino]phenyl]ethyl] ethanethioate
CID 58599182
2-(4-nitrophenyl)thiophene
CID 609512
2-(3-methylsulfonylphenyl)thiophene
CID 141164326
4-N-fluorobenzene-1,4-disulfonamide
CID 175065506
N-[5-[(3S,5R)-3,5-dimethylpiperazin-1-yl]-2-fluoro-4-methoxyphenyl]-4-thiophen-2-ylbenzenesulfonamide
CID 69198105
2-methyl-N-[5-(4-thiophen-2-ylanilino)pentyl]propane-2-sulfonamide
CID 59230144
methyl 3-thiophen-2-ylbenzenesulfonate
CID 174847423
2-hydroxy-5-thiophen-2-ylcyclohepta-2,4,6-trien-1-one
CID 102462555
4-(4-thiophen-2-ylphenyl)benzoic acid
CID 53472759
2,6-dithiophen-2-ylanthracene-9,10-dione
CID 11079243

Frequently Asked Questions

What is the IUPAC name of N-fluoro-4-thiophen-2-ylbenzenesulfonamide?
The IUPAC name of N-fluoro-4-thiophen-2-ylbenzenesulfonamide (CID 87730443) is N-fluoro-4-thiophen-2-ylbenzenesulfonamide.
What is the SMILES notation for N-fluoro-4-thiophen-2-ylbenzenesulfonamide?
The canonical SMILES for N-fluoro-4-thiophen-2-ylbenzenesulfonamide is O=S(=O)(NF)c1ccc(-c2cccs2)cc1.
What is the InChIKey of N-fluoro-4-thiophen-2-ylbenzenesulfonamide?
The InChIKey is HFVXDAKGNHUOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO2S2/c11-12-16(13,14)9-5-3-8(4-6-9)10-2-1-7-15-10/h1-7,12H.
What are the key properties of N-fluoro-4-thiophen-2-ylbenzenesulfonamide?
N-fluoro-4-thiophen-2-ylbenzenesulfonamide has a molecular weight of 257.31 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-4-thiophen-2-ylbenzenesulfonamide is sourced from PubChem (CID 87730443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).