N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide

C10H13NO3S — CID 62065932

IUPACN-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1COc2ccccc21
InChIInChI=1S/C10H13NO3S/c1-2-15(12,13)11-9-7-14-10-6-4-3-5-8(9)10/h3-6,9,11H,2,7H2,1H3
InChIKeyIRSPTRXKSZGXAI-UHFFFAOYSA-N
MW227.28 g/mol
LogP1.06
Rot. Bonds3

About N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide

N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide (PubChem CID 62065932) has the molecular formula C10H13NO3S and a molecular weight of 227.28 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide
PubChem CID62065932
Molecular FormulaC10H13NO3S
Molecular Weight227.28 g/mol
Exact Mass227.06
IUPAC NameN-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1COc2ccccc21
InChIInChI=1S/C10H13NO3S/c1-2-15(12,13)11-9-7-14-10-6-4-3-5-8(9)10/h3-6,9,11H,2,7H2,1H3
InChIKeyIRSPTRXKSZGXAI-UHFFFAOYSA-N
XLogP1.06
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1-benzofuran-3-yl)-3-(methylamino)propane-1-sulfonamide
CID 106067237
3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
CID 110751655
N-(2,3-dihydro-1-benzofuran-3-yl)propane-2-sulfonamide
CID 62066112
(3S)-3-[[cyclohexyl(methyl)sulfamoyl]amino]-2,3-dihydro-1-benzofuran
CID 95592046
2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide
CID 110751703
2-bromo-N-(2,3-dihydro-1-benzofuran-3-yl)-4-methylbenzenesulfonamide
CID 62066677
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)methanesulfonamide
CID 110751798
3-(2,3-dihydro-1-benzofuran-3-yl)-1-ethyl-1-methylurea
CID 115604588
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-1-phenylmethanesulfonamide
CID 33038573
N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanesulfonamide
CID 17388085
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]methanesulfonamide
CID 94197081
methyl 2-(2,3-dihydro-1-benzofuran-3-ylamino)butanoate
CID 113292622

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide (CID 62065932) is N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide is CCS(=O)(=O)NC1COc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide?
The InChIKey is IRSPTRXKSZGXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S/c1-2-15(12,13)11-9-7-14-10-6-4-3-5-8(9)10/h3-6,9,11H,2,7H2,1H3.
What are the key properties of N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide?
N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide has a molecular weight of 227.28 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide is sourced from PubChem (CID 62065932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).