N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide

C17H18Cl2N2O3S — CID 3998601

IUPACN-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C17H18Cl2N2O3S/c1-2-20-25(23,24)13-9-6-12(7-10-13)8-11-16(22)21-15-5-3-4-14(18)17(15)19/h3-7,9-10,20H,2,8,11H2,1H3,(H,21,22)
InChIKeyJYPWUWDZYQRWNH-UHFFFAOYSA-N
MW401.32 g/mol
LogP3.86
Rot. Bonds7

About N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide

N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide (PubChem CID 3998601) has the molecular formula C17H18Cl2N2O3S and a molecular weight of 401.32 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
PubChem CID3998601
Molecular FormulaC17H18Cl2N2O3S
Molecular Weight401.32 g/mol
Exact Mass400.04
IUPAC NameN-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C17H18Cl2N2O3S/c1-2-20-25(23,24)13-9-6-12(7-10-13)8-11-16(22)21-15-5-3-4-14(18)17(15)19/h3-7,9-10,20H,2,8,11H2,1H3,(H,21,22)
InChIKeyJYPWUWDZYQRWNH-UHFFFAOYSA-N
XLogP3.86
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.32
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
CID 2984291
3-[4-(ethylsulfamoyl)phenyl]-N-(2-methoxyphenyl)propanamide
CID 2227902
3-[4-(ethylsulfamoyl)phenyl]-N-(2-phenoxyphenyl)propanamide
CID 126395833
3-[(4-bromophenyl)sulfonylamino]-N-(2,3-dichlorophenyl)propanamide
CID 17192422
N-(2-chlorophenyl)-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 3661392
N-(3-bromophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
CID 3627107
1-[(4-butylphenyl)sulfonylamino]-3-(2,3-dichlorophenyl)urea
CID 2954418
N-(2,3-dichlorophenyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide
CID 17192926
N-(4-bromophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide
CID 3466870
3-[4-(ethylsulfamoyl)phenyl]-N-propylpropanamide
CID 2224602
N-(2-bromophenyl)-3-[4-(propylsulfamoyl)phenyl]propanamide
CID 126267768
N-(2,3-dimethylphenyl)-3-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
CID 126236704

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide (CID 3998601) is N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide is CCNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The InChIKey is JYPWUWDZYQRWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O3S/c1-2-20-25(23,24)13-9-6-12(7-10-13)8-11-16(22)21-15-5-3-4-14(18)17(15)19/h3-7,9-10,20H,2,8,11H2,1H3,(H,21,22).
What are the key properties of N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide?
N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide has a molecular weight of 401.32 g/mol, XLogP of 3.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-3-[4-(ethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 3998601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).