N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide

C12H18N4O3S — CID 28775811

IUPACN-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NS(=O)(=O)N2CCNCC2)c1
InChIInChI=1S/C12H18N4O3S/c1-10(17)14-11-3-2-4-12(9-11)15-20(18,19)16-7-5-13-6-8-16/h2-4,9,13,15H,5-8H2,1H3,(H,14,17)
InChIKeyALULUZKLTIBGQV-UHFFFAOYSA-N
MW298.37 g/mol
LogP0.21
Rot. Bonds4

About N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide

N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide (PubChem CID 28775811) has the molecular formula C12H18N4O3S and a molecular weight of 298.37 g/mol. Its IUPAC name is N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
PubChem CID28775811
Molecular FormulaC12H18N4O3S
Molecular Weight298.37 g/mol
Exact Mass298.11
IUPAC NameN-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NS(=O)(=O)N2CCNCC2)c1
InChIInChI=1S/C12H18N4O3S/c1-10(17)14-11-3-2-4-12(9-11)15-20(18,19)16-7-5-13-6-8-16/h2-4,9,13,15H,5-8H2,1H3,(H,14,17)
InChIKeyALULUZKLTIBGQV-UHFFFAOYSA-N
XLogP0.21
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-methyl-3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
CID 61251789
N-[4-fluoro-3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
CID 61252527
N-methyl-4-(piperazin-1-ylsulfonylamino)benzamide
CID 61253139
N-(3,4-dicyanophenyl)piperazine-1-sulfonamide
CID 107791270
N-[3-[[3-(azepan-1-yl)-3-oxopropyl]sulfonylamino]phenyl]acetamide
CID 110416843
2-(piperazin-1-ylsulfonylamino)benzoic acid
CID 61251958
N-(3-fluoro-5-methylphenyl)piperazine-1-sulfonamide
CID 79049509
(2S,6S)-N-(3-acetylphenyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 95337073
N-(4-cyanophenyl)piperazine-1-sulfonamide
CID 28775902
N-[3-[[3-(4-methylpiperidin-1-yl)-3-oxopropyl]sulfonylamino]phenyl]acetamide
CID 110407310
N-[3-[[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]sulfonylamino]phenyl]acetamide
CID 110408469
N-(3-acetamidophenyl)-4-(4-methylsulfonylpiperazin-1-yl)-4-oxobutanamide
CID 42534412

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide?
The IUPAC name of N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide (CID 28775811) is N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide.
What is the SMILES notation for N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide?
The canonical SMILES for N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide is CC(=O)Nc1cccc(NS(=O)(=O)N2CCNCC2)c1.
What is the InChIKey of N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide?
The InChIKey is ALULUZKLTIBGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3S/c1-10(17)14-11-3-2-4-12(9-11)15-20(18,19)16-7-5-13-6-8-16/h2-4,9,13,15H,5-8H2,1H3,(H,14,17).
What are the key properties of N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide?
N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide has a molecular weight of 298.37 g/mol, XLogP of 0.21, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide is sourced from PubChem (CID 28775811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).