N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide

C20H26N2O3S — CID 21214992

IUPACN-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)c2ccccc2)c(C)c1
InChIInChI=1S/C20H26N2O3S/c1-5-22(6-2)26(24,25)18-12-13-19(15(3)14-18)21-20(23)16(4)17-10-8-7-9-11-17/h7-14,16H,5-6H2,1-4H3,(H,21,23)
InChIKeyHGPOGYGJCDJWNL-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.77
Rot. Bonds7

About N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide

N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide (PubChem CID 21214992) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide
PubChem CID21214992
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)c2ccccc2)c(C)c1
InChIInChI=1S/C20H26N2O3S/c1-5-22(6-2)26(24,25)18-12-13-19(15(3)14-18)21-20(23)16(4)17-10-8-7-9-11-17/h7-14,16H,5-6H2,1-4H3,(H,21,23)
InChIKeyHGPOGYGJCDJWNL-UHFFFAOYSA-N
XLogP3.77
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 ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9132046
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,2-diphenylacetamide
CID 26891804
N-(4-hydroxy-2,5-dimethylphenyl)-2-phenylpropanamide
CID 106834835
[1-(2-methylanilino)-1-oxopropan-2-yl] 2-chloro-5-(diethylsulfamoyl)benzoate
CID 6915026
N-(2,4-dimethylphenyl)-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide
CID 3955899
(2S)-2-amino-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]propanamide
CID 119267327
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 3485774
2-[benzyl-(3,4-dimethylphenyl)sulfonylamino]-N-(2,4-dimethylphenyl)acetamide
CID 18286925
N-[2-(diethylamino)-5-(diethylsulfamoyl)phenyl]-2-methylbutanamide
CID 46511241
2-phenyl-N-(2,2,7-trimethylchromen-6-yl)propanamide
CID 54176266
4-(2-ethylbutanoylamino)-3-methylbenzenesulfonic acid
CID 72947233
N-(2-chlorophenyl)-2-phenylpropanamide
CID 70678301

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide?
The IUPAC name of N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide (CID 21214992) is N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)c2ccccc2)c(C)c1.
What is the InChIKey of N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide?
The InChIKey is HGPOGYGJCDJWNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-5-22(6-2)26(24,25)18-12-13-19(15(3)14-18)21-20(23)16(4)17-10-8-7-9-11-17/h7-14,16H,5-6H2,1-4H3,(H,21,23).
What are the key properties of N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide?
N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide has a molecular weight of 374.51 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)-2-methylphenyl]-2-phenylpropanamide is sourced from PubChem (CID 21214992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).