N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide

C18H22N2O4S — CID 51298085

IUPACN-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccccc2OC)c1
InChIInChI=1S/C18H22N2O4S/c1-13-9-10-15(25(22,23)19-2)11-16(13)18(21)20(3)12-14-7-5-6-8-17(14)24-4/h5-11,19H,12H2,1-4H3
InChIKeyBOMXJGDNLWBMRS-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.18
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide

N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide (PubChem CID 51298085) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide
PubChem CID51298085
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccccc2OC)c1
InChIInChI=1S/C18H22N2O4S/c1-13-9-10-15(25(22,23)19-2)11-16(13)18(21)20(3)12-14-7-5-6-8-17(14)24-4/h5-11,19H,12H2,1-4H3
InChIKeyBOMXJGDNLWBMRS-UHFFFAOYSA-N
XLogP2.18
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylsulfamoyl)-N-[(2-fluorophenyl)methyl]-N,2-dimethylbenzamide
CID 31138800
N,2-dimethyl-5-(methylsulfamoyl)-N-[(3-methylthiophen-2-yl)methyl]benzamide
CID 51328637
N-[(5-bromo-2-methoxyphenyl)methyl]-N,2-dimethyl-5-sulfamoylbenzamide
CID 24544465
N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 25497844
N-[(2-methoxyphenyl)methyl]-N-methyl-2-methylsulfanylbenzamide
CID 38005257
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-methyl-5-(methylsulfamoyl)benzamide
CID 24614043
N-benzyl-5-(ethylsulfamoyl)-2-methoxy-N-methylbenzamide
CID 19257900
N-[(2,4-difluorophenyl)methyl]-5-(2-methoxyethylsulfamoyl)-N,2-dimethylbenzamide
CID 43049204
[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate
CID 55367003
3-amino-N-[(2-methoxyphenyl)methyl]-N,4-dimethylbenzamide
CID 61027377
5-amino-2-chloro-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 61111701
5-amino-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61112841

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide (CID 51298085) is N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccccc2OC)c1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide?
The InChIKey is BOMXJGDNLWBMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-13-9-10-15(25(22,23)19-2)11-16(13)18(21)20(3)12-14-7-5-6-8-17(14)24-4/h5-11,19H,12H2,1-4H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide?
N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide has a molecular weight of 362.45 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N,2-dimethyl-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 51298085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).