N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide

C17H20N2O4S — CID 6462480

IUPACN-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-13(20)18-15-6-10-17(11-7-15)24(21,22)19(2)12-14-4-8-16(23-3)9-5-14/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyBDEDTJSEVMUEOT-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.47
Rot. Bonds6

About N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide

N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide (PubChem CID 6462480) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
PubChem CID6462480
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C17H20N2O4S/c1-13(20)18-15-6-10-17(11-7-15)24(21,22)19(2)12-14-4-8-16(23-3)9-5-14/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyBDEDTJSEVMUEOT-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-[4-[(4-hydroxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
CID 139950958
N-(4-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide
CID 1316906
N-[4-[[benzenesulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]phenyl]acetamide
CID 141361158
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 3318426
4-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]benzoic acid
CID 100553172
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192752
N-benzyl-4-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzenesulfonamide
CID 1025614
N-[4-[(2-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
CID 30328422
N-(4-acetamidophenyl)-2-[acetyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 113163156
N-[4-(dimethylsulfamoyl)phenyl]-3-(4-methoxyphenyl)propanamide
CID 2440554
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 2709966
2-(N-(4-acetamidophenyl)sulfonyl-4-methoxyanilino)-N,N-dibenzylacetamide
CID 2889288

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide (CID 6462480) is N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide is COc1ccc(CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide?
The InChIKey is BDEDTJSEVMUEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-13(20)18-15-6-10-17(11-7-15)24(21,22)19(2)12-14-4-8-16(23-3)9-5-14/h4-11H,12H2,1-3H3,(H,18,20).
What are the key properties of N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide?
N-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]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-[4-[(4-methoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 6462480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).