N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide

C19H24N2O4S — CID 38702132

IUPACN-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide
SMILESCOCCN(Cc1ccccc1)C(=O)c1ccc(C)c(NS(C)(=O)=O)c1
InChIInChI=1S/C19H24N2O4S/c1-15-9-10-17(13-18(15)20-26(3,23)24)19(22)21(11-12-25-2)14-16-7-5-4-6-8-16/h4-10,13,20H,11-12,14H2,1-3H3
InChIKeyWYWWRAPTGXOJEZ-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.66
Rot. Bonds8

About N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide

N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide (PubChem CID 38702132) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide
PubChem CID38702132
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide
SMILESCOCCN(Cc1ccccc1)C(=O)c1ccc(C)c(NS(C)(=O)=O)c1
InChIInChI=1S/C19H24N2O4S/c1-15-9-10-17(13-18(15)20-26(3,23)24)19(22)21(11-12-25-2)14-16-7-5-4-6-8-16/h4-10,13,20H,11-12,14H2,1-3H3
InChIKeyWYWWRAPTGXOJEZ-UHFFFAOYSA-N
XLogP2.66
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[3-(methanesulfonamido)-4-methylbenzoyl]-(2-methoxyethyl)amino]acetic acid
CID 119189349
N-benzyl-N-[2-(diethylamino)ethyl]-3-(methanesulfonamido)-4-methylbenzamide
CID 60591541
N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)benzamide
CID 31236388
N-benzyl-N-(2-methoxyethyl)-3-[(4-methoxyphenyl)sulfamoyl]-4-methylbenzamide
CID 43017329
N-benzyl-4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
CID 38518080
3-(methanesulfonamido)-4-methyl-N,N-dipropylbenzamide
CID 134062114
N-benzyl-3-(diethylsulfamoyl)-N-(2-methoxyethyl)benzamide
CID 9094420
N-benzyl-3-[(2-chlorophenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 60520179
N-benzyl-N-(2-methoxyethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 134028376
N-benzyl-4-[(carbamoylamino)methyl]-N-(2-methoxyethyl)benzamide
CID 17419919
N-benzyl-N-(2-methoxyethyl)-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
CID 46555724
N-benzyl-4-(3,5-dimethylpyrazol-1-yl)-N-(2-methoxyethyl)benzamide
CID 26292074

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide?
The IUPAC name of N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide (CID 38702132) is N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide.
What is the SMILES notation for N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide?
The canonical SMILES for N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide is COCCN(Cc1ccccc1)C(=O)c1ccc(C)c(NS(C)(=O)=O)c1.
What is the InChIKey of N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide?
The InChIKey is WYWWRAPTGXOJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-15-9-10-17(13-18(15)20-26(3,23)24)19(22)21(11-12-25-2)14-16-7-5-4-6-8-16/h4-10,13,20H,11-12,14H2,1-3H3.
What are the key properties of N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide?
N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide has a molecular weight of 376.48 g/mol, XLogP of 2.66, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(methanesulfonamido)-N-(2-methoxyethyl)-4-methylbenzamide is sourced from PubChem (CID 38702132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).