2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide

C23H32N4O4S — CID 16597782

IUPAC2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCCN(CC)S(=O)(=O)N1CCN(CC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1
InChIInChI=1S/C23H32N4O4S/c1-3-26(4-2)32(29,30)27-16-14-25(15-17-27)18-23(28)24-21-10-12-22(13-11-21)31-19-20-8-6-5-7-9-20/h5-13H,3-4,14-19H2,1-2H3,(H,24,28)
InChIKeyWBWRGNMPSLGSLH-UHFFFAOYSA-N
MW460.60 g/mol
LogP2.41
Rot. Bonds10

About 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 16597782) has the molecular formula C23H32N4O4S and a molecular weight of 460.60 g/mol. Its IUPAC name is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID16597782
Molecular FormulaC23H32N4O4S
Molecular Weight460.60 g/mol
Exact Mass460.21
IUPAC Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCCN(CC)S(=O)(=O)N1CCN(CC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1
InChIInChI=1S/C23H32N4O4S/c1-3-26(4-2)32(29,30)27-16-14-25(15-17-27)18-23(28)24-21-10-12-22(13-11-21)31-19-20-8-6-5-7-9-20/h5-13H,3-4,14-19H2,1-2H3,(H,24,28)
InChIKeyWBWRGNMPSLGSLH-UHFFFAOYSA-N
XLogP2.41
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.60
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylphenyl)acetamide
CID 55498988
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-iodophenyl)acetamide
CID 16597807
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-[4-(dimethylamino)phenyl]acetamide
CID 16597798
N-(4-tert-butylphenyl)-2-[4-(diethylsulfamoyl)piperazin-1-yl]acetamide
CID 16597788
2-(4-aminopiperidin-1-yl)-N-(4-phenylmethoxyphenyl)acetamide;hydrochloride
CID 119907132
N-(3-chlorophenyl)-2-[4-(diethylsulfamoyl)piperazin-1-yl]acetamide
CID 17426375
2-(1,4-diazepan-1-yl)-N-(4-phenylmethoxyphenyl)acetamide;hydrochloride
CID 119905944
2-[4-[2-(4-ethoxyanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-ethoxyphenyl)acetamide
CID 20970562
3-(4-ethylpiperazin-1-yl)-3-oxo-N-(4-phenylmethoxyphenyl)propanamide
CID 108944636
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)acetamide
CID 43039531
3-(4-methylpiperazin-1-yl)-N-(4-phenylmethoxyphenyl)propanamide
CID 574794
1-(dimethylsulfamoyl)-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 41454969

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide (CID 16597782) is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide is CCN(CC)S(=O)(=O)N1CCN(CC(=O)Nc2ccc(OCc3ccccc3)cc2)CC1.
What is the InChIKey of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is WBWRGNMPSLGSLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O4S/c1-3-26(4-2)32(29,30)27-16-14-25(15-17-27)18-23(28)24-21-10-12-22(13-11-21)31-19-20-8-6-5-7-9-20/h5-13H,3-4,14-19H2,1-2H3,(H,24,28).
What are the key properties of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide?
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 460.60 g/mol, XLogP of 2.41, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 16597782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).