4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide

C20H26N2O3S — CID 46441337

IUPAC4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)NCC(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-22-26(24,25)18-12-10-17(11-13-18)20(23)21-14-19(15(2)3)16-8-6-5-7-9-16/h5-13,15,19,22H,4,14H2,1-3H3,(H,21,23)
InChIKeyWQAQRXGGBSAGJH-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.15
Rot. Bonds8

About 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide

4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide (PubChem CID 46441337) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide.

Molecular Properties

Compound Name4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide
PubChem CID46441337
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)NCC(c2ccccc2)C(C)C)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-22-26(24,25)18-12-10-17(11-13-18)20(23)21-14-19(15(2)3)16-8-6-5-7-9-16/h5-13,15,19,22H,4,14H2,1-3H3,(H,21,23)
InChIKeyWQAQRXGGBSAGJH-UHFFFAOYSA-N
XLogP3.15
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(diethylamino)propyl]-4-(ethylsulfamoyl)benzamide
CID 46432829
N-(2-amino-2-phenylethyl)-4-(2-methylpropylsulfamoyl)benzamide;hydrochloride
CID 119528684
2-[[4-(ethylsulfamoyl)benzoyl]amino]acetic acid
CID 16768249
4-(ethylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 51160983
4-(ethylsulfamoyl)-N-phenylbenzamide
CID 1262046
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
N-benzyl-4-(2-methylpropylsulfamoyl)benzamide
CID 109058915
4-[4-(benzylsulfamoyl)phenyl]-N-(2-methylpropyl)benzamide
CID 20973707
[2-oxo-2-(1-phenylethylamino)ethyl] 4-(ethylsulfamoyl)benzoate
CID 18085655
N-[2-(dimethylamino)-2-phenylethyl]-4-(prop-2-ynylsulfamoyl)benzamide
CID 51297941
4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348

Frequently Asked Questions

What is the IUPAC name of 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide?
The IUPAC name of 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide (CID 46441337) is 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide.
What is the SMILES notation for 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide?
The canonical SMILES for 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide is CCNS(=O)(=O)c1ccc(C(=O)NCC(c2ccccc2)C(C)C)cc1.
What is the InChIKey of 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide?
The InChIKey is WQAQRXGGBSAGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-4-22-26(24,25)18-12-10-17(11-13-18)20(23)21-14-19(15(2)3)16-8-6-5-7-9-16/h5-13,15,19,22H,4,14H2,1-3H3,(H,21,23).
What are the key properties of 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide?
4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide has a molecular weight of 374.51 g/mol, XLogP of 3.15, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfamoyl)-N-(3-methyl-2-phenylbutyl)benzamide is sourced from PubChem (CID 46441337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).