N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

C17H20N2O4S — CID 51297742

IUPACN-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCCOc1ccc(NC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1
InChIInChI=1S/C17H20N2O4S/c1-4-23-14-8-6-13(7-9-14)19-17(20)16-11-15(10-5-12(16)2)24(21,22)18-3/h5-11,18H,4H2,1-3H3,(H,19,20)
InChIKeyNRUZTYODZIVCKK-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.55
Rot. Bonds6

About N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (PubChem CID 51297742) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
PubChem CID51297742
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCCOc1ccc(NC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1
InChIInChI=1S/C17H20N2O4S/c1-4-23-14-8-6-13(7-9-14)19-17(20)16-11-15(10-5-12(16)2)24(21,22)18-3/h5-11,18H,4H2,1-3H3,(H,19,20)
InChIKeyNRUZTYODZIVCKK-UHFFFAOYSA-N
XLogP2.55
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-5-[(4-fluorophenyl)sulfamoyl]-2-methylbenzamide
CID 26561579
N-(4-ethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297821
1-(4-ethoxyphenyl)-3-[4-(methylsulfamoyl)phenyl]urea
CID 971008
N-[4-(cyanomethyl)phenyl]-2-methyl-5-(methylsulfamoyl)benzamide
CID 35708143
N-(4-ethoxyphenyl)-2-methylbenzamide
CID 710558
5-[(4-fluorophenyl)sulfamoyl]-2-methyl-N-[4-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 134010401
3-[[(4-ethoxybenzoyl)amino]carbamoyl]-N-(4-fluorophenyl)-4-methylbenzenesulfonamide
CID 27620814
5-(cyclopropylsulfamoyl)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-methylbenzamide
CID 30859946
2-methyl-N-(3-methylphenyl)-5-(methylsulfamoyl)benzamide
CID 51297733
N-[3-(cyanomethoxy)phenyl]-2-methyl-5-(methylsulfamoyl)benzamide
CID 55752004
N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 39971961
N-(4-ethoxyphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7779984

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (CID 51297742) is N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is CCOc1ccc(NC(=O)c2cc(S(=O)(=O)NC)ccc2C)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The InChIKey is NRUZTYODZIVCKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-4-23-14-8-6-13(7-9-14)19-17(20)16-11-15(10-5-12(16)2)24(21,22)18-3/h5-11,18H,4H2,1-3H3,(H,19,20).
What are the key properties of N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 51297742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).