N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide

C14H16N2O3S2 — CID 16553822

IUPACN-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)s1
InChIInChI=1S/C14H16N2O3S2/c1-10-3-5-12(6-4-10)16-21(18,19)14-8-7-13(20-14)9-15-11(2)17/h3-8,16H,9H2,1-2H3,(H,15,17)
InChIKeyXJUSIFYEDGJOJZ-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.49
Rot. Bonds5

About N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide

N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide (PubChem CID 16553822) has the molecular formula C14H16N2O3S2 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
PubChem CID16553822
Molecular FormulaC14H16N2O3S2
Molecular Weight324.43 g/mol
Exact Mass324.06
IUPAC NameN-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)s1
InChIInChI=1S/C14H16N2O3S2/c1-10-3-5-12(6-4-10)16-21(18,19)14-8-7-13(20-14)9-15-11(2)17/h3-8,16H,9H2,1-2H3,(H,15,17)
InChIKeyXJUSIFYEDGJOJZ-UHFFFAOYSA-N
XLogP2.49
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]benzoate
CID 16553849
N-[[5-[(4-butan-2-ylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553889
N-[[5-[(3,4-dimethoxyphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553867
N-[[5-[(4-acetamido-3-chlorophenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16604918
N-[[5-[[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 122296926
(4-methylphenyl) 5-(acetamidomethyl)thiophene-2-sulfonate
CID 39792029
N-[2-[5-[(3,5-dimethylphenyl)sulfamoyl]thiophen-2-yl]ethyl]acetamide
CID 47068610
N-[[5-[(4-methyl-3-morpholin-4-ylsulfonylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553878
N-[[5-[[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 122287728
N-[[5-[[4-[[6-(3,4,5-trimethylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 122292418
N-[[5-[(2-amino-2-methylpropyl)sulfamoyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 119988458
N-[[5-(phenylsulfamoyl)thiophen-2-yl]methyl]benzamide
CID 2823706

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide (CID 16553822) is N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide is CC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)s1.
What is the InChIKey of N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
The InChIKey is XJUSIFYEDGJOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S2/c1-10-3-5-12(6-4-10)16-21(18,19)14-8-7-13(20-14)9-15-11(2)17/h3-8,16H,9H2,1-2H3,(H,15,17).
What are the key properties of N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide?
N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide has a molecular weight of 324.43 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 16553822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).