N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide

C17H16N2O2S2 — CID 112986152

IUPACN-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
SMILESCN(c1ccccc1)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C17H16N2O2S2/c1-19(15-6-3-2-4-7-15)16-11-9-14(10-12-16)18-23(20,21)17-8-5-13-22-17/h2-13,18H,1H3
InChIKeyZTGYTZWYEOUOLN-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.32
Rot. Bonds5

About N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide

N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide (PubChem CID 112986152) has the molecular formula C17H16N2O2S2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
PubChem CID112986152
Molecular FormulaC17H16N2O2S2
Molecular Weight344.46 g/mol
Exact Mass344.07
IUPAC NameN-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
SMILESCN(c1ccccc1)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C17H16N2O2S2/c1-19(15-6-3-2-4-7-15)16-11-9-14(10-12-16)18-23(20,21)17-8-5-13-22-17/h2-13,18H,1H3
InChIKeyZTGYTZWYEOUOLN-UHFFFAOYSA-N
XLogP4.32
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[benzyl(methyl)amino]phenyl]thiophene-2-sulfonamide
CID 112982346
5-methyl-N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986153
5-chloro-N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986155
[1-(N-methylanilino)-1-oxopropan-2-yl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 55352238
N-[4-[2-(dimethylamino)ethylamino]phenyl]thiophene-2-sulfonamide
CID 112981383
N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 5002728
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1092869
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]thiophene-2-sulfonamide
CID 8519544
N-[4-[(4-methylphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1075762
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]thiophene-2-sulfonamide
CID 24703518
N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 43416696
N-(3-benzyl-4-methoxyphenyl)thiophene-2-sulfonamide
CID 27301138

Frequently Asked Questions

What is the IUPAC name of N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide (CID 112986152) is N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide is CN(c1ccccc1)c1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide?
The InChIKey is ZTGYTZWYEOUOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2S2/c1-19(15-6-3-2-4-7-15)16-11-9-14(10-12-16)18-23(20,21)17-8-5-13-22-17/h2-13,18H,1H3.
What are the key properties of N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide?
N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide has a molecular weight of 344.46 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 112986152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).