N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide

C17H20N2O4S — CID 26945772

IUPACN-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C17H20N2O4S/c1-13(20)18-15-9-10-16(23-3)17(11-15)24(21,22)19(2)12-14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyRYJBTHBPMDNEQV-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.47
Rot. Bonds6

About N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide

N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide (PubChem CID 26945772) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
PubChem CID26945772
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C17H20N2O4S/c1-13(20)18-15-9-10-16(23-3)17(11-15)24(21,22)19(2)12-14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyRYJBTHBPMDNEQV-UHFFFAOYSA-N
XLogP2.47
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(2-chlorophenyl)methyl-methylsulfamoyl]-4-methoxyphenyl]acetamide
CID 9320671
N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide
CID 31391604
N-[4-methoxy-3-[methyl-[(3-methylthiophen-2-yl)methyl]sulfamoyl]phenyl]acetamide
CID 9406654
3-[benzyl(methyl)sulfamoyl]-4-methoxy-N-[2-(methylamino)ethyl]benzamide
CID 119503968
2-[benzyl-(2-methoxy-5-methylphenyl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 3898762
2-[benzyl-(2-methoxy-5-methylphenyl)sulfonylamino]-N-(3,4-dimethylphenyl)acetamide
CID 4537352
N-[3-[cyclohexyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 17402561
3-[benzyl(methyl)sulfamoyl]-N-[(4-chlorophenyl)methyl]-4-methoxy-N-methylbenzamide
CID 31986975
2-[benzyl(methyl)amino]-N-(3,4-dimethoxyphenyl)acetamide
CID 8901253
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3,3-dimethylbutanamide
CID 9109103
3-[benzyl(methyl)sulfamoyl]-4-methoxy-N-[4-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55489776
[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] 3-[benzyl(methyl)sulfamoyl]-4-methoxybenzoate
CID 31118187

Frequently Asked Questions

What is the IUPAC name of N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide?
The IUPAC name of N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide (CID 26945772) is N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide.
What is the SMILES notation for N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide?
The canonical SMILES for N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide is COc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide?
The InChIKey is RYJBTHBPMDNEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-13(20)18-15-9-10-16(23-3)17(11-15)24(21,22)19(2)12-14-7-5-4-6-8-14/h4-11H,12H2,1-3H3,(H,18,20).
What are the key properties of N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide?
N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide has a molecular weight of 348.42 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide is sourced from PubChem (CID 26945772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).