3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran

C10H14N2O3S — CID 110751655

IUPAC3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
SMILESCN(C)S(=O)(=O)NC1COc2ccccc21
InChIInChI=1S/C10H14N2O3S/c1-12(2)16(13,14)11-9-7-15-10-6-4-3-5-8(9)10/h3-6,9,11H,7H2,1-2H3
InChIKeyUJAZPWIJUFUARV-UHFFFAOYSA-N
MW242.30 g/mol
LogP0.52
Rot. Bonds3

About 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran

3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran (PubChem CID 110751655) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
PubChem CID110751655
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
SMILESCN(C)S(=O)(=O)NC1COc2ccccc21
InChIInChI=1S/C10H14N2O3S/c1-12(2)16(13,14)11-9-7-15-10-6-4-3-5-8(9)10/h3-6,9,11H,7H2,1-2H3
InChIKeyUJAZPWIJUFUARV-UHFFFAOYSA-N
XLogP0.52
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-[[cyclohexyl(methyl)sulfamoyl]amino]-2,3-dihydro-1-benzofuran
CID 95592046
N-(2,3-dihydro-1-benzofuran-3-yl)ethanesulfonamide
CID 62065932
N-(2,3-dihydro-1-benzofuran-3-yl)propane-2-sulfonamide
CID 62066112
2-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)benzenesulfonamide
CID 110751703
N-(2,3-dihydro-1-benzofuran-3-yl)-3-(methylamino)propane-1-sulfonamide
CID 106067237
(4R)-4-[[methyl(propan-2-yl)sulfamoyl]amino]-3,4-dihydro-2H-chromene
CID 94026699
2-bromo-N-(2,3-dihydro-1-benzofuran-3-yl)-4-methylbenzenesulfonamide
CID 62066677
3-(2,3-dihydro-1-benzofuran-3-yl)-1-ethyl-1-methylurea
CID 115604588
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]methanesulfonamide
CID 94197081
2,3-dihydro-1-benzofuran-3-ylurea
CID 62065035
N-(2,3-dihydro-1-benzofuran-3-ylmethyl)methanesulfonamide
CID 110751798
5,6-dichloro-N-(2,3-dihydro-1-benzofuran-3-yl)pyridine-3-sulfonamide
CID 64608045

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran?
The IUPAC name of 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran (CID 110751655) is 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran?
The canonical SMILES for 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran is CN(C)S(=O)(=O)NC1COc2ccccc21.
What is the InChIKey of 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran?
The InChIKey is UJAZPWIJUFUARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-12(2)16(13,14)11-9-7-15-10-6-4-3-5-8(9)10/h3-6,9,11H,7H2,1-2H3.
What are the key properties of 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran?
3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran has a molecular weight of 242.30 g/mol, XLogP of 0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 110751655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).