4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide

C19H24N2O4S — CID 18113163

IUPAC4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide
SMILESCN(CCOc1ccccc1)C(=O)c1ccc(CCNS(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-21(14-15-25-18-6-4-3-5-7-18)19(22)17-10-8-16(9-11-17)12-13-20-26(2,23)24/h3-11,20H,12-15H2,1-2H3
InChIKeyXTKDCZLLRBDNEI-UHFFFAOYSA-N
MW376.48 g/mol
LogP1.93
Rot. Bonds9

About 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide

4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide (PubChem CID 18113163) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide.

Molecular Properties

Compound Name4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide
PubChem CID18113163
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide
SMILESCN(CCOc1ccccc1)C(=O)c1ccc(CCNS(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-21(14-15-25-18-6-4-3-5-7-18)19(22)17-10-8-16(9-11-17)12-13-20-26(2,23)24/h3-11,20H,12-15H2,1-2H3
InChIKeyXTKDCZLLRBDNEI-UHFFFAOYSA-N
XLogP1.93
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-benzoylphenyl)ethyl]methanesulfonamide
CID 110667350
N-methyl-3-methylsulfonyl-N-(2-phenoxyethyl)benzamide
CID 27822055
4-[2-(methanesulfonamido)ethyl]-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 27021904
N-methyl-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 60676178
4-(furan-2-ylmethylsulfamoyl)-N-methyl-N-(2-phenoxyethyl)benzamide
CID 2555092
4-bromo-3-(dimethylsulfamoyl)-N-methyl-N-(2-phenoxyethyl)benzamide
CID 46798216
4-(azepan-1-ylsulfonyl)-N-methyl-N-(2-phenoxyethyl)benzamide
CID 8960788
N-methyl-N-(3-phenoxypropyl)-4-(phenylsulfamoyl)benzamide
CID 38579965
N-[2-(4-methoxyphenoxy)ethyl]-N-methyl-4-methylsulfonylbenzamide
CID 9429656
N-[2-(methanesulfonamido)ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47034582
4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 27017885
[(1R)-2-(dimethylamino)-2-oxo-1-phenylethyl] 4-[2-(methanesulfonamido)ethyl]benzoate
CID 27614893

Frequently Asked Questions

What is the IUPAC name of 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The IUPAC name of 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide (CID 18113163) is 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide.
What is the SMILES notation for 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The canonical SMILES for 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide is CN(CCOc1ccccc1)C(=O)c1ccc(CCNS(C)(=O)=O)cc1.
What is the InChIKey of 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
The InChIKey is XTKDCZLLRBDNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-21(14-15-25-18-6-4-3-5-7-18)19(22)17-10-8-16(9-11-17)12-13-20-26(2,23)24/h3-11,20H,12-15H2,1-2H3.
What are the key properties of 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide?
4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide has a molecular weight of 376.48 g/mol, XLogP of 1.93, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(methanesulfonamido)ethyl]-N-methyl-N-(2-phenoxyethyl)benzamide is sourced from PubChem (CID 18113163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).