2,3-dihydro-1-benzofuran-5-sulfonamide

C8H9NO3S — CID 10899619

IUPAC2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C8H9NO3S/c9-13(10,11)7-1-2-8-6(5-7)3-4-12-8/h1-2,5H,3-4H2,(H2,9,10,11)
InChIKeyYSWWLKULIVOPEP-UHFFFAOYSA-N
MW199.23 g/mol
LogP0.27
Rot. Bonds1

About 2,3-dihydro-1-benzofuran-5-sulfonamide

2,3-dihydro-1-benzofuran-5-sulfonamide (PubChem CID 10899619) has the molecular formula C8H9NO3S and a molecular weight of 199.23 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-5-sulfonamide.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-5-sulfonamide
PubChem CID10899619
Molecular FormulaC8H9NO3S
Molecular Weight199.23 g/mol
Exact Mass199.03
IUPAC Name2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C8H9NO3S/c9-13(10,11)7-1-2-8-6(5-7)3-4-12-8/h1-2,5H,3-4H2,(H2,9,10,11)
InChIKeyYSWWLKULIVOPEP-UHFFFAOYSA-N
XLogP0.27
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-5-sulfonamide?
The IUPAC name of 2,3-dihydro-1-benzofuran-5-sulfonamide (CID 10899619) is 2,3-dihydro-1-benzofuran-5-sulfonamide.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-5-sulfonamide?
The canonical SMILES for 2,3-dihydro-1-benzofuran-5-sulfonamide is NS(=O)(=O)c1ccc2c(c1)CCO2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-5-sulfonamide?
The InChIKey is YSWWLKULIVOPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3S/c9-13(10,11)7-1-2-8-6(5-7)3-4-12-8/h1-2,5H,3-4H2,(H2,9,10,11).
What are the key properties of 2,3-dihydro-1-benzofuran-5-sulfonamide?
2,3-dihydro-1-benzofuran-5-sulfonamide has a molecular weight of 199.23 g/mol, XLogP of 0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-5-sulfonamide is sourced from PubChem (CID 10899619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).