4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide

C20H26N2O3S — CID 46568364

IUPAC4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
SMILESCC(C)CC(NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3S/c1-15(2)14-19(16-8-6-5-7-9-16)21-20(23)17-10-12-18(13-11-17)26(24,25)22(3)4/h5-13,15,19H,14H2,1-4H3,(H,21,23)
InChIKeyAMGFDCNOLXFJDS-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.45
Rot. Bonds7

About 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide

4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide (PubChem CID 46568364) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
PubChem CID46568364
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
SMILESCC(C)CC(NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3S/c1-15(2)14-19(16-8-6-5-7-9-16)21-20(23)17-10-12-18(13-11-17)26(24,25)22(3)4/h5-13,15,19H,14H2,1-4H3,(H,21,23)
InChIKeyAMGFDCNOLXFJDS-UHFFFAOYSA-N
XLogP3.45
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[benzenesulfonyl(methyl)amino]-N-[(1S)-3-methyl-1-phenylbutyl]benzamide
CID 92646480
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-4-(dimethylsulfamoyl)benzamide
CID 8936839
4-(dimethylsulfamoyl)-N-(1-phenylethyl)benzamide
CID 2914743
N-(3-methyl-1-phenylbutyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 46568326
N-(3-methyl-1-phenylbutyl)benzamide
CID 46770250
4-chloro-3-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
CID 46568374
4-amino-N-(3-methyl-1-phenylbutyl)benzamide
CID 43707132
4-(cyclopropylsulfamoyl)-N-[(1R)-3-methyl-1-phenylbutyl]benzamide
CID 27853449
3-[[4-(dimethylsulfamoyl)benzoyl]amino]-2-methyl-3-phenylpropanoic acid
CID 119218999
(2R)-2-[[4-(dimethylsulfamoyl)benzoyl]amino]-4-methylpentanoate
CID 9441550
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
4-acetamido-N-(3-methyl-1-phenylbutyl)benzamide
CID 78799180

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide (CID 46568364) is 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide is CC(C)CC(NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide?
The InChIKey is AMGFDCNOLXFJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-15(2)14-19(16-8-6-5-7-9-16)21-20(23)17-10-12-18(13-11-17)26(24,25)22(3)4/h5-13,15,19H,14H2,1-4H3,(H,21,23).
What are the key properties of 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide?
4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide has a molecular weight of 374.51 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide is sourced from PubChem (CID 46568364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).