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

C10H10FNO3S — CID 165487463

IUPACN-ethyl-6-fluoro-1-benzofuran-7-sulfonamide
SMILESCCNS(=O)(=O)c1c(F)ccc2ccoc12
InChIInChI=1S/C10H10FNO3S/c1-2-12-16(13,14)10-8(11)4-3-7-5-6-15-9(7)10/h3-6,12H,2H2,1H3
InChIKeyYPBFFBXJLCSGOR-UHFFFAOYSA-N
MW243.26 g/mol
LogP1.87
Rot. Bonds3

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

N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide (PubChem CID 165487463) has the molecular formula C10H10FNO3S and a molecular weight of 243.26 g/mol. Its IUPAC name is N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide.

Molecular Properties

Compound NameN-ethyl-6-fluoro-1-benzofuran-7-sulfonamide
PubChem CID165487463
Molecular FormulaC10H10FNO3S
Molecular Weight243.26 g/mol
Exact Mass243.04
IUPAC NameN-ethyl-6-fluoro-1-benzofuran-7-sulfonamide
SMILESCCNS(=O)(=O)c1c(F)ccc2ccoc12
InChIInChI=1S/C10H10FNO3S/c1-2-12-16(13,14)10-8(11)4-3-7-5-6-15-9(7)10/h3-6,12H,2H2,1H3
InChIKeyYPBFFBXJLCSGOR-UHFFFAOYSA-N
XLogP1.87
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Benzofuran-2-Sulfonamide
CID 10750432
N-[2-(2,2,2-trifluoroethoxy)ethyl]dibenzo[b,d]furan-2-sulfonamide
CID 2972762
N-[2-(2,2,3,3-tetrafluoropropoxy)ethyl]dibenzo[b,d]furan-2-sulfonamide
CID 3236646
1-Benzofuran-7-sulfonyl chloride
CID 49762852
1-Benzofuran-3-sulfonyl chloride
CID 55279079
N-(1-(furan-2-yl)propan-2-yl)-3-(trifluoromethyl)benzenesulfonamide
CID 49676485
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
Ethyl 2-[(7-fluoro-1-benzofuran-2-yl)sulfonylamino]acetate
CID 15158745
2-[(7-Fluoro-1-benzofuran-2-yl)sulfonylamino]acetic acid
CID 15158757

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide?
The IUPAC name of N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide (CID 165487463) is N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide.
What is the SMILES notation for N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide?
The canonical SMILES for N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide is CCNS(=O)(=O)c1c(F)ccc2ccoc12.
What is the InChIKey of N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide?
The InChIKey is YPBFFBXJLCSGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3S/c1-2-12-16(13,14)10-8(11)4-3-7-5-6-15-9(7)10/h3-6,12H,2H2,1H3.
What are the key properties of N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide?
N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide has a molecular weight of 243.26 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-fluoro-1-benzofuran-7-sulfonamide is sourced from PubChem (CID 165487463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).