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

C18H30N4O3S — CID 17428462

IUPAC2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
SMILESCCN(CC)S(=O)(=O)N1CCN(CC(=O)NC(C)c2ccccc2)CC1
InChIInChI=1S/C18H30N4O3S/c1-4-21(5-2)26(24,25)22-13-11-20(12-14-22)15-18(23)19-16(3)17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3,(H,19,23)
InChIKeyWGZSYRHNFUMJFU-UHFFFAOYSA-N
MW382.53 g/mol
LogP1.07
Rot. Bonds8

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

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide (PubChem CID 17428462) has the molecular formula C18H30N4O3S and a molecular weight of 382.53 g/mol. Its IUPAC name is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
PubChem CID17428462
Molecular FormulaC18H30N4O3S
Molecular Weight382.53 g/mol
Exact Mass382.20
IUPAC Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
SMILESCCN(CC)S(=O)(=O)N1CCN(CC(=O)NC(C)c2ccccc2)CC1
InChIInChI=1S/C18H30N4O3S/c1-4-21(5-2)26(24,25)22-13-11-20(12-14-22)15-18(23)19-16(3)17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3,(H,19,23)
InChIKeyWGZSYRHNFUMJFU-UHFFFAOYSA-N
XLogP1.07
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.53
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylphenyl)acetamide
CID 55498988
2-[4,7-bis[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]-1,4,7,10-tetrazacyclododec-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 11285246
ethyl 4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazine-1-carboxylate
CID 8932163
N-(1-phenylethyl)-2-piperazin-1-ylacetamide
CID 23080516
2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(1S)-1-phenylethyl]acetamide
CID 8730834
2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 8730839
N-(1-phenylethyl)-2-[4-(2-phenylethyl)piperazin-1-yl]acetamide
CID 18125323
2-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]-N-(1-phenylethyl)acetamide
CID 55411010
N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-1-yl]acetamide
CID 9435748
N-(4-methylphenyl)-2-[4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-1-yl]acetamide
CID 30722668
2-(4-aminopiperidin-1-yl)-N-(1-phenylethyl)acetamide
CID 43556855
N-(3-chlorophenyl)-2-[4-(diethylsulfamoyl)piperazin-1-yl]acetamide
CID 17426375

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide (CID 17428462) is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide is CCN(CC)S(=O)(=O)N1CCN(CC(=O)NC(C)c2ccccc2)CC1.
What is the InChIKey of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide?
The InChIKey is WGZSYRHNFUMJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O3S/c1-4-21(5-2)26(24,25)22-13-11-20(12-14-22)15-18(23)19-16(3)17-9-7-6-8-10-17/h6-10,16H,4-5,11-15H2,1-3H3,(H,19,23).
What are the key properties of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide?
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide has a molecular weight of 382.53 g/mol, XLogP of 1.07, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 17428462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).