N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide

C15H15NO4S — CID 2810598

IUPACN-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1
InChIInChI=1S/C15H15NO4S/c1-19-13-4-2-12(3-5-13)16-21(17,18)14-6-7-15-11(10-14)8-9-20-15/h2-7,10,16H,8-9H2,1H3
InChIKeyOVXYZAJFYLXDHL-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.43
Rot. Bonds4

About N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide

N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide (PubChem CID 2810598) has the molecular formula C15H15NO4S and a molecular weight of 305.36 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
PubChem CID2810598
Molecular FormulaC15H15NO4S
Molecular Weight305.36 g/mol
Exact Mass305.07
IUPAC NameN-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1
InChIInChI=1S/C15H15NO4S/c1-19-13-4-2-12(3-5-13)16-21(17,18)14-6-7-15-11(10-14)8-9-20-15/h2-7,10,16H,8-9H2,1H3
InChIKeyOVXYZAJFYLXDHL-UHFFFAOYSA-N
XLogP2.43
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-Ethoxyphenyl)-4-methylbenzenesulfonamide
CID 284083
N-(4-ethylphenyl)-2-oxo-2H-chromene-6-sulfonamide
CID 935188
N-(4-chlorophenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 2810596
N-(4-phenylmethoxyphenyl)methanesulfonamide
CID 669037
N-(4-methoxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 2442232
4-methoxy-N-(2-methylphenyl)benzenesulfonamide
CID 796476
N-(4-phenylmethoxyphenyl)benzenesulfonamide
CID 799154
4-methoxy-N-(2-methoxyphenyl)-3-methylbenzenesulfonamide
CID 893150
N-(4-ethoxyphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 893786
4-ethoxy-N-(4-fluorophenyl)-2,3-dimethylbenzenesulfonamide
CID 935391
4-ethoxy-N-(4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 2237332
N-(3-(2-aminoethyl)-4-methoxyphenyl)benzenesulfonamide
CID 11849204

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide?
The IUPAC name of N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide (CID 2810598) is N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide is COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide?
The InChIKey is OVXYZAJFYLXDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4S/c1-19-13-4-2-12(3-5-13)16-21(17,18)14-6-7-15-11(10-14)8-9-20-15/h2-7,10,16H,8-9H2,1H3.
What are the key properties of N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide?
N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide has a molecular weight of 305.36 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide is sourced from PubChem (CID 2810598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).