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

C17H28N4O3S — CID 16597890

IUPAC2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide
SMILESCCN(CC)S(=O)(=O)N1CCN(C(C)C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C17H28N4O3S/c1-4-20(5-2)25(23,24)21-13-11-19(12-14-21)15(3)17(22)18-16-9-7-6-8-10-16/h6-10,15H,4-5,11-14H2,1-3H3,(H,18,22)
InChIKeyLBGOVGCRRPBLFC-UHFFFAOYSA-N
MW368.50 g/mol
LogP1.22
Rot. Bonds7

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

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide (PubChem CID 16597890) has the molecular formula C17H28N4O3S and a molecular weight of 368.50 g/mol. Its IUPAC name is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide
PubChem CID16597890
Molecular FormulaC17H28N4O3S
Molecular Weight368.50 g/mol
Exact Mass368.19
IUPAC Name2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide
SMILESCCN(CC)S(=O)(=O)N1CCN(C(C)C(=O)Nc2ccccc2)CC1
InChIInChI=1S/C17H28N4O3S/c1-4-20(5-2)25(23,24)21-13-11-19(12-14-21)15(3)17(22)18-16-9-7-6-8-10-16/h6-10,15H,4-5,11-14H2,1-3H3,(H,18,22)
InChIKeyLBGOVGCRRPBLFC-UHFFFAOYSA-N
XLogP1.22
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 55498702
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(3-sulfamoylphenyl)propanamide
CID 16597974
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 55498397
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-methylphenyl)-2-phenylacetamide
CID 16597867
N-phenyl-2-piperidin-1-ylpropanamide
CID 4788909
2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-phenylpropanamide
CID 55351317
(2R)-2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-phenylpropanamide
CID 51894730
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(4-phenylphenyl)acetamide
CID 55498988
(2S)-2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(4-chlorophenyl)propanamide
CID 8512070
2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-N-phenylpropanamide
CID 18224972
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
CID 17428462
(2R)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(4-phenylpiperazin-1-yl)propanamide
CID 40809914

Frequently Asked Questions

What is the IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide?
The IUPAC name of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide (CID 16597890) is 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide.
What is the SMILES notation for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide?
The canonical SMILES for 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide is CCN(CC)S(=O)(=O)N1CCN(C(C)C(=O)Nc2ccccc2)CC1.
What is the InChIKey of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide?
The InChIKey is LBGOVGCRRPBLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O3S/c1-4-20(5-2)25(23,24)21-13-11-19(12-14-21)15(3)17(22)18-16-9-7-6-8-10-16/h6-10,15H,4-5,11-14H2,1-3H3,(H,18,22).
What are the key properties of 2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide?
2-[4-(diethylsulfamoyl)piperazin-1-yl]-N-phenylpropanamide has a molecular weight of 368.50 g/mol, XLogP of 1.22, 7 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-phenylpropanamide is sourced from PubChem (CID 16597890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).