N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide

C18H23N5O3S — CID 42317786

IUPACN-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide
SMILESCCCC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cnccn3)CC2)cc1
InChIInChI=1S/C18H23N5O3S/c1-2-3-18(24)21-15-4-6-16(7-5-15)27(25,26)23-12-10-22(11-13-23)17-14-19-8-9-20-17/h4-9,14H,2-3,10-13H2,1H3,(H,21,24)
InChIKeySBZOSPBPPZENAN-UHFFFAOYSA-N
MW389.48 g/mol
LogP1.73
Rot. Bonds6

About N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide

N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide (PubChem CID 42317786) has the molecular formula C18H23N5O3S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide.

Molecular Properties

Compound NameN-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide
PubChem CID42317786
Molecular FormulaC18H23N5O3S
Molecular Weight389.48 g/mol
Exact Mass389.15
IUPAC NameN-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide
SMILESCCCC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cnccn3)CC2)cc1
InChIInChI=1S/C18H23N5O3S/c1-2-3-18(24)21-15-4-6-16(7-5-15)27(25,26)23-12-10-22(11-13-23)17-14-19-8-9-20-17/h4-9,14H,2-3,10-13H2,1H3,(H,21,24)
InChIKeySBZOSPBPPZENAN-UHFFFAOYSA-N
XLogP1.73
TPSA95.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42317830
2-propyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]pentanamide
CID 42317806
2-phenyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42318039
2-(4-ethoxyphenyl)-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42318049
2-cyclohexyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42317816
2-(2-methoxyphenoxy)-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42318009
3,4-dimethyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide
CID 42317857
2-fluoro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide
CID 42317902
2,4-dichloro-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide
CID 42317930
N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]naphthalene-2-carboxamide
CID 42317966
N-(4-morpholin-4-ylsulfonylphenyl)butanamide
CID 832695
2-(difluoromethylsulfanyl)-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]benzamide
CID 42318251

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide?
The IUPAC name of N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide (CID 42317786) is N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide.
What is the SMILES notation for N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide?
The canonical SMILES for N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide is CCCC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cnccn3)CC2)cc1.
What is the InChIKey of N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide?
The InChIKey is SBZOSPBPPZENAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O3S/c1-2-3-18(24)21-15-4-6-16(7-5-15)27(25,26)23-12-10-22(11-13-23)17-14-19-8-9-20-17/h4-9,14H,2-3,10-13H2,1H3,(H,21,24).
What are the key properties of N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide?
N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide has a molecular weight of 389.48 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide is sourced from PubChem (CID 42317786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).