4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide

C20H26N2O4S — CID 109058831

IUPAC4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide
SMILESCOc1ccccc1CCNS(=O)(=O)c1ccc(C(=O)NCC(C)C)cc1
InChIInChI=1S/C20H26N2O4S/c1-15(2)14-21-20(23)17-8-10-18(11-9-17)27(24,25)22-13-12-16-6-4-5-7-19(16)26-3/h4-11,15,22H,12-14H2,1-3H3,(H,21,23)
InChIKeyUMGUCSXJUOIYKE-UHFFFAOYSA-N
MW390.51 g/mol
LogP2.60
Rot. Bonds9

About 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide

4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide (PubChem CID 109058831) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide
PubChem CID109058831
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC Name4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide
SMILESCOc1ccccc1CCNS(=O)(=O)c1ccc(C(=O)NCC(C)C)cc1
InChIInChI=1S/C20H26N2O4S/c1-15(2)14-21-20(23)17-8-10-18(11-9-17)27(24,25)22-13-12-16-6-4-5-7-19(16)26-3/h4-11,15,22H,12-14H2,1-3H3,(H,21,23)
InChIKeyUMGUCSXJUOIYKE-UHFFFAOYSA-N
XLogP2.60
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-4-[2-(2-methoxyphenyl)ethylsulfamoyl]benzamide
CID 109059025
4-[(2-methoxyphenyl)methylsulfamoyl]-N-pentylbenzamide
CID 109060818
3-(benzenesulfonamido)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 31115017
2-[2-(2-methoxyphenyl)ethylamino]-N-(2-methylpropyl)propanamide
CID 103604200
N-[2-(2-methoxyphenyl)ethyl]-4-methylbenzamide
CID 8911194
N-[2-(2-fluorophenyl)ethyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 35613709
4-[4-(benzylsulfamoyl)phenyl]-N-(2-methylpropyl)benzamide
CID 20973707
4-(methanesulfonamido)-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 41477402
N-(3-methylbutyl)-4-(2-phenylethylsulfamoyl)benzamide
CID 109061010
N-[(2-chlorophenyl)methyl]-4-(3-methylbutylsulfamoyl)benzamide
CID 109060799
4-[(2-methoxyphenyl)sulfamoyl]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120832379
4-fluoro-3-[2-(2-methoxyphenyl)ethylsulfamoyl]benzoate
CID 9160272

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide?
The IUPAC name of 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide (CID 109058831) is 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide is COc1ccccc1CCNS(=O)(=O)c1ccc(C(=O)NCC(C)C)cc1.
What is the InChIKey of 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide?
The InChIKey is UMGUCSXJUOIYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-15(2)14-21-20(23)17-8-10-18(11-9-17)27(24,25)22-13-12-16-6-4-5-7-19(16)26-3/h4-11,15,22H,12-14H2,1-3H3,(H,21,23).
What are the key properties of 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide?
4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide has a molecular weight of 390.51 g/mol, XLogP of 2.60, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyphenyl)ethylsulfamoyl]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 109058831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).