N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide

C16H20N2O4S2 — CID 60516900

IUPACN-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCOc1ccc(CCNS(=O)(=O)c2ccc(CNC(C)=O)s2)cc1
InChIInChI=1S/C16H20N2O4S2/c1-12(19)17-11-15-7-8-16(23-15)24(20,21)18-10-9-13-3-5-14(22-2)6-4-13/h3-8,18H,9-11H2,1-2H3,(H,17,19)
InChIKeyFMCZVLVFOLTESB-UHFFFAOYSA-N
MW368.48 g/mol
LogP1.91
Rot. Bonds8

About N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide

N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide (PubChem CID 60516900) has the molecular formula C16H20N2O4S2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
PubChem CID60516900
Molecular FormulaC16H20N2O4S2
Molecular Weight368.48 g/mol
Exact Mass368.09
IUPAC NameN-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCOc1ccc(CCNS(=O)(=O)c2ccc(CNC(C)=O)s2)cc1
InChIInChI=1S/C16H20N2O4S2/c1-12(19)17-11-15-7-8-16(23-15)24(20,21)18-10-9-13-3-5-14(22-2)6-4-13/h3-8,18H,9-11H2,1-2H3,(H,17,19)
InChIKeyFMCZVLVFOLTESB-UHFFFAOYSA-N
XLogP1.91
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-[2-[4-(2-methylpropoxy)phenyl]ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 86896965
5-ethyl-N-[2-(4-methoxyphenyl)ethyl]thiophene-2-sulfonamide
CID 113098193
N-[[5-(2-methoxyethylsulfamoyl)thiophen-2-yl]methyl]acetamide
CID 30180963
N-[[5-[(4-methoxyphenyl)methyl-methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55353278
N-[5-(acetamidomethyl)thiophen-2-yl]sulfonyl-3-methoxybenzamide
CID 71882520
N-[[5-[2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 86879604
N-[[5-[(2-amino-2-methylpropyl)sulfamoyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 119988458
N-[[5-[3-[benzyl(methyl)amino]propylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55435788
N-[[5-[(3,4-dimethoxyphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553867
N-[2-[5-[2-(2-methoxyethylamino)ethylsulfamoyl]thiophen-2-yl]ethyl]acetamide
CID 120717361
N-[[5-[2-[[6-(ethylamino)-2-methylpyrimidin-4-yl]amino]ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 122293527
(4-methylphenyl) 5-(acetamidomethyl)thiophene-2-sulfonate
CID 39792029

Frequently Asked Questions

What is the IUPAC name of N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide (CID 60516900) is N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide is COc1ccc(CCNS(=O)(=O)c2ccc(CNC(C)=O)s2)cc1.
What is the InChIKey of N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide?
The InChIKey is FMCZVLVFOLTESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4S2/c1-12(19)17-11-15-7-8-16(23-15)24(20,21)18-10-9-13-3-5-14(22-2)6-4-13/h3-8,18H,9-11H2,1-2H3,(H,17,19).
What are the key properties of N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide?
N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide has a molecular weight of 368.48 g/mol, XLogP of 1.91, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[2-(4-methoxyphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 60516900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).