N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide

C16H18N2O4S — CID 134019085

IUPACN-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide
SMILESCOc1ccc(NC(=O)c2ccccc2C)cc1NS(C)(=O)=O
InChIInChI=1S/C16H18N2O4S/c1-11-6-4-5-7-13(11)16(19)17-12-8-9-15(22-2)14(10-12)18-23(3,20)21/h4-10,18H,1-3H3,(H,17,19)
InChIKeyJFJOJTPIEPWKKB-UHFFFAOYSA-N
MW334.40 g/mol
LogP2.63
Rot. Bonds5

About N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide

N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide (PubChem CID 134019085) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide
PubChem CID134019085
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC NameN-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide
SMILESCOc1ccc(NC(=O)c2ccccc2C)cc1NS(C)(=O)=O
InChIInChI=1S/C16H18N2O4S/c1-11-6-4-5-7-13(11)16(19)17-12-8-9-15(22-2)14(10-12)18-23(3,20)21/h4-10,18H,1-3H3,(H,17,19)
InChIKeyJFJOJTPIEPWKKB-UHFFFAOYSA-N
XLogP2.63
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamido-4-methoxyphenyl)-2-(methanesulfonamido)benzamide
CID 25484331
N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylfuran-3-carboxamide
CID 134019111
3-fluoro-N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-methylbenzamide
CID 39975934
3-(cyclopropanecarbonylamino)-N-[3-(methanesulfonamido)-4-methoxyphenyl]naphthalene-2-carboxamide
CID 24673279
N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 24673316
N-[1-[4-(methanesulfonamido)-3-methoxyanilino]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide
CID 55618994
N-[3-(methanesulfonamido)-4-methoxyphenyl]isoquinoline-1-carboxamide
CID 52788633
5-fluoro-N-[3-[(4-fluorophenyl)sulfonylamino]-4-methoxyphenyl]-2-methylbenzamide
CID 34092220
2-(methanesulfonamido)-N-(2-methoxyphenyl)benzamide
CID 1266369
N-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylphenyl]-2,3-dimethylbenzamide
CID 3879769
N-[3-(methanesulfonamido)-4-methoxyphenyl]-3-phenylpropanamide
CID 134019079
2-chloro-N-[3-(methanesulfonamido)-4-methoxyphenyl]-4-nitrobenzamide
CID 39975932

Frequently Asked Questions

What is the IUPAC name of N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide?
The IUPAC name of N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide (CID 134019085) is N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide.
What is the SMILES notation for N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide?
The canonical SMILES for N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide is COc1ccc(NC(=O)c2ccccc2C)cc1NS(C)(=O)=O.
What is the InChIKey of N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide?
The InChIKey is JFJOJTPIEPWKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c1-11-6-4-5-7-13(11)16(19)17-12-8-9-15(22-2)14(10-12)18-23(3,20)21/h4-10,18H,1-3H3,(H,17,19).
What are the key properties of N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide?
N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide has a molecular weight of 334.40 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-methylbenzamide is sourced from PubChem (CID 134019085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).