6-fluoro-N-methyl-1-benzofuran-7-sulfonamide

C9H8FNO3S — CID 165487462

IUPAC6-fluoro-N-methyl-1-benzofuran-7-sulfonamide
SMILESCNS(=O)(=O)c1c(F)ccc2ccoc12
InChIInChI=1S/C9H8FNO3S/c1-11-15(12,13)9-7(10)3-2-6-4-5-14-8(6)9/h2-5,11H,1H3
InChIKeyWJUTVFMUCNIYGY-UHFFFAOYSA-N
MW229.23 g/mol
LogP1.48
Rot. Bonds2

About 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide

6-fluoro-N-methyl-1-benzofuran-7-sulfonamide (PubChem CID 165487462) has the molecular formula C9H8FNO3S and a molecular weight of 229.23 g/mol. Its IUPAC name is 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide.

Molecular Properties

Compound Name6-fluoro-N-methyl-1-benzofuran-7-sulfonamide
PubChem CID165487462
Molecular FormulaC9H8FNO3S
Molecular Weight229.23 g/mol
Exact Mass229.02
IUPAC Name6-fluoro-N-methyl-1-benzofuran-7-sulfonamide
SMILESCNS(=O)(=O)c1c(F)ccc2ccoc12
InChIInChI=1S/C9H8FNO3S/c1-11-15(12,13)9-7(10)3-2-6-4-5-14-8(6)9/h2-5,11H,1H3
InChIKeyWJUTVFMUCNIYGY-UHFFFAOYSA-N
XLogP1.48
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Benzofuran-2-Sulfonamide
CID 10750432
1-Benzofuran-7-sulfonyl chloride
CID 49762852
1-Benzofuran-3-sulfonyl chloride
CID 55279079
3-Methyl-1-benzofuran-5-sulfonyl chloride
CID 82390792
5-Fluoro-1-benzofuran-2-sulfonyl chloride
CID 83896263
7-Fluoro-1-benzofuran-4-sulfonyl chloride
CID 132398508
2-Methyl-1-benzofuran-3-sulfonyl chloride
CID 167724688
Cambridge id 7042318
CID 2924981
3-Benzofuransulfonamide
CID 67273585
1-(1-Benzofuran-7-ylsulfonyl)-3-ethylazetidine
CID 128775195
N-[(4S)-8-oxaspiro[4.5]decan-4-yl]-1-benzofuran-7-sulfonamide
CID 164635694
N-[(3S)-1-methylpyrrolidin-3-yl]-1-benzofuran-7-sulfonamide
CID 164641167

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide?
The IUPAC name of 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide (CID 165487462) is 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide.
What is the SMILES notation for 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide?
The canonical SMILES for 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide is CNS(=O)(=O)c1c(F)ccc2ccoc12.
What is the InChIKey of 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide?
The InChIKey is WJUTVFMUCNIYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO3S/c1-11-15(12,13)9-7(10)3-2-6-4-5-14-8(6)9/h2-5,11H,1H3.
What are the key properties of 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide?
6-fluoro-N-methyl-1-benzofuran-7-sulfonamide has a molecular weight of 229.23 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methyl-1-benzofuran-7-sulfonamide is sourced from PubChem (CID 165487462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).