N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide

C16H25ClN2O3S — CID 113056291

IUPACN-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide
SMILESCCCCS(=O)(=O)NCCN(CCc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C16H25ClN2O3S/c1-3-4-13-23(21,22)18-10-12-19(14(2)20)11-9-15-5-7-16(17)8-6-15/h5-8,18H,3-4,9-13H2,1-2H3
InChIKeyGPKBIWDSHBWVCT-UHFFFAOYSA-N
MW360.91 g/mol
LogP2.45
Rot. Bonds10

About N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide

N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide (PubChem CID 113056291) has the molecular formula C16H25ClN2O3S and a molecular weight of 360.91 g/mol. Its IUPAC name is N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide
PubChem CID113056291
Molecular FormulaC16H25ClN2O3S
Molecular Weight360.91 g/mol
Exact Mass360.13
IUPAC NameN-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide
SMILESCCCCS(=O)(=O)NCCN(CCc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C16H25ClN2O3S/c1-3-4-13-23(21,22)18-10-12-19(14(2)20)11-9-15-5-7-16(17)8-6-15/h5-8,18H,3-4,9-13H2,1-2H3
InChIKeyGPKBIWDSHBWVCT-UHFFFAOYSA-N
XLogP2.45
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.91
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113056288
N-[2-(benzenesulfonamido)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 113056293
3-[acetyl-[2-(4-chlorophenyl)ethyl]amino]-N-butylpropanamide
CID 113121920
N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 113055790
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-propylacetamide
CID 113051944
N-[2-(ethylsulfonylamino)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 113056192
N-[2-(4-chloro-N-methylanilino)ethyl]butane-1-sulfonamide
CID 110664517
N-benzyl-N-[2-(3-phenylpropylsulfonylamino)ethyl]acetamide
CID 113054093
N-butyl-N-[2-(ethylsulfonylamino)ethyl]acetamide
CID 113052446
N-[2-[acetyl-[2-(4-chlorophenyl)ethyl]amino]ethyl]-3-methylbutanamide
CID 113056238
2-[acetyl(butyl)amino]-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 113158667
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[2-(ethylsulfonylamino)ethyl]acetamide
CID 113056230

Frequently Asked Questions

What is the IUPAC name of N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide?
The IUPAC name of N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide (CID 113056291) is N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide is CCCCS(=O)(=O)NCCN(CCc1ccc(Cl)cc1)C(C)=O.
What is the InChIKey of N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide?
The InChIKey is GPKBIWDSHBWVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O3S/c1-3-4-13-23(21,22)18-10-12-19(14(2)20)11-9-15-5-7-16(17)8-6-15/h5-8,18H,3-4,9-13H2,1-2H3.
What are the key properties of N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide?
N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide has a molecular weight of 360.91 g/mol, XLogP of 2.45, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(butylsulfonylamino)ethyl]-N-[2-(4-chlorophenyl)ethyl]acetamide is sourced from PubChem (CID 113056291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).