N,2-dimethyl-1-benzothiophene-3-sulfonamide

C10H11NO2S2 — CID 71973591

IUPACN,2-dimethyl-1-benzothiophene-3-sulfonamide
SMILESCNS(=O)(=O)c1c(C)sc2ccccc12
InChIInChI=1S/C10H11NO2S2/c1-7-10(15(12,13)11-2)8-5-3-4-6-9(8)14-7/h3-6,11H,1-2H3
InChIKeyKCAWRDGZPMYNPT-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.12
Rot. Bonds2

About N,2-dimethyl-1-benzothiophene-3-sulfonamide

N,2-dimethyl-1-benzothiophene-3-sulfonamide (PubChem CID 71973591) has the molecular formula C10H11NO2S2 and a molecular weight of 241.34 g/mol. Its IUPAC name is N,2-dimethyl-1-benzothiophene-3-sulfonamide.

Molecular Properties

Compound NameN,2-dimethyl-1-benzothiophene-3-sulfonamide
PubChem CID71973591
Molecular FormulaC10H11NO2S2
Molecular Weight241.34 g/mol
Exact Mass241.02
IUPAC NameN,2-dimethyl-1-benzothiophene-3-sulfonamide
SMILESCNS(=O)(=O)c1c(C)sc2ccccc12
InChIInChI=1S/C10H11NO2S2/c1-7-10(15(12,13)11-2)8-5-3-4-6-9(8)14-7/h3-6,11H,1-2H3
InChIKeyKCAWRDGZPMYNPT-UHFFFAOYSA-N
XLogP2.12
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Benzothiophene-2-Sulfonamide
CID 10680096
4-(1-Benzothiophen-2-yl)benzenesulfonamide
CID 127029023
4-(2-Phenyl-1-benzothiophen-3-yl)benzenesulfonamide
CID 44142500
2,5-dimethyl-N-(2-phenylethyl)thiophene-3-sulfonamide
CID 711867
1-Benzothiophene-3-sulfonamide
CID 13178324
N-(1-benzothiophen-2-ylmethyl)-2-fluorobenzenesulfonamide
CID 141518729
N-(1-benzothiophen-2-ylmethyl)-4-fluorobenzenesulfonamide
CID 141518730
N-(1-benzothiophen-2-ylmethyl)-4-methylbenzenesulfonamide
CID 141518731
N-(1-benzothiophen-2-ylmethyl)-3-fluorobenzenesulfonamide
CID 141518735
3-Methyl-1-benzothiophene-2-sulfonyl chloride
CID 2736815
1-Benzothiophene-2-sulfonyl chloride
CID 2776333
1-Benzothiophene-3-sulfonyl chloride
CID 2776340

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-benzothiophene-3-sulfonamide?
The IUPAC name of N,2-dimethyl-1-benzothiophene-3-sulfonamide (CID 71973591) is N,2-dimethyl-1-benzothiophene-3-sulfonamide.
What is the SMILES notation for N,2-dimethyl-1-benzothiophene-3-sulfonamide?
The canonical SMILES for N,2-dimethyl-1-benzothiophene-3-sulfonamide is CNS(=O)(=O)c1c(C)sc2ccccc12.
What is the InChIKey of N,2-dimethyl-1-benzothiophene-3-sulfonamide?
The InChIKey is KCAWRDGZPMYNPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2S2/c1-7-10(15(12,13)11-2)8-5-3-4-6-9(8)14-7/h3-6,11H,1-2H3.
What are the key properties of N,2-dimethyl-1-benzothiophene-3-sulfonamide?
N,2-dimethyl-1-benzothiophene-3-sulfonamide has a molecular weight of 241.34 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-benzothiophene-3-sulfonamide is sourced from PubChem (CID 71973591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).