N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide

C15H24N4O3S — CID 119966333

IUPACN-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)NCCN2CCNCC2)cc1
InChIInChI=1S/C15H24N4O3S/c1-2-15(20)18-13-3-5-14(6-4-13)23(21,22)17-9-12-19-10-7-16-8-11-19/h3-6,16-17H,2,7-12H2,1H3,(H,18,20)
InChIKeyPAQPSRHMMFFHCF-UHFFFAOYSA-N
MW340.45 g/mol
LogP0.22
Rot. Bonds7

About N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide

N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide (PubChem CID 119966333) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide
PubChem CID119966333
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC NameN-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide
SMILESCCC(=O)Nc1ccc(S(=O)(=O)NCCN2CCNCC2)cc1
InChIInChI=1S/C15H24N4O3S/c1-2-15(20)18-13-3-5-14(6-4-13)23(21,22)17-9-12-19-10-7-16-8-11-19/h3-6,16-17H,2,7-12H2,1H3,(H,18,20)
InChIKeyPAQPSRHMMFFHCF-UHFFFAOYSA-N
XLogP0.22
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-methyl-4-piperazin-1-ylbutan-2-yl)oxyphenyl]propanamide
CID 139638977
N-[4-(2-pyrrolidin-3-ylethylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119977058
N-(2-piperazin-1-ylethyl)-4-(trifluoromethyl)benzenesulfonamide
CID 119966218
N-[4-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propylsulfamoyl]phenyl]propanamide
CID 42389365
N-[4-[2-(ethylamino)ethylsulfamoyl]phenyl]propanamide;hydrochloride
CID 119973592
N-[4-[2-(propylamino)ethylsulfamoyl]phenyl]propanamide
CID 120715921
N-[4-[3-(methylamino)propylsulfamoyl]phenyl]propanamide
CID 119964786
3-chloro-4-methyl-N-(2-piperazin-1-ylethyl)benzenesulfonamide
CID 119966394
4-nitro-N-(2-piperazin-1-ylethyl)benzenesulfonamide;dihydrochloride
CID 119966206
4-(2-methoxyethyl)-N-(2-piperazin-1-ylethyl)benzenesulfonamide
CID 119966559
4-bromo-3-methyl-N-(2-piperazin-1-ylethyl)benzenesulfonamide
CID 43605186
3-[(4-nitrophenyl)sulfonylamino]-N-(2-piperazin-1-ylethyl)propanamide
CID 119445662

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide (CID 119966333) is N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide is CCC(=O)Nc1ccc(S(=O)(=O)NCCN2CCNCC2)cc1.
What is the InChIKey of N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide?
The InChIKey is PAQPSRHMMFFHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-2-15(20)18-13-3-5-14(6-4-13)23(21,22)17-9-12-19-10-7-16-8-11-19/h3-6,16-17H,2,7-12H2,1H3,(H,18,20).
What are the key properties of N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide?
N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide has a molecular weight of 340.45 g/mol, XLogP of 0.22, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-piperazin-1-ylethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 119966333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).