N-(4-cyanophenyl)piperazine-1-sulfonamide

C11H14N4O2S — CID 28775902

IUPACN-(4-cyanophenyl)piperazine-1-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)N2CCNCC2)cc1
InChIInChI=1S/C11H14N4O2S/c12-9-10-1-3-11(4-2-10)14-18(16,17)15-7-5-13-6-8-15/h1-4,13-14H,5-8H2
InChIKeyGLAKRLHAOOBVME-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.12
Rot. Bonds3

About N-(4-cyanophenyl)piperazine-1-sulfonamide

N-(4-cyanophenyl)piperazine-1-sulfonamide (PubChem CID 28775902) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is N-(4-cyanophenyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)piperazine-1-sulfonamide
PubChem CID28775902
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC NameN-(4-cyanophenyl)piperazine-1-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)N2CCNCC2)cc1
InChIInChI=1S/C11H14N4O2S/c12-9-10-1-3-11(4-2-10)14-18(16,17)15-7-5-13-6-8-15/h1-4,13-14H,5-8H2
InChIKeyGLAKRLHAOOBVME-UHFFFAOYSA-N
XLogP0.12
TPSA85.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyanophenyl)piperidine-1-sulfonamide
CID 28785044
N-(4-cyanophenyl)morpholine-4-sulfonamide
CID 28785040
N-(3,4-dicyanophenyl)piperazine-1-sulfonamide
CID 107791270
N-methyl-4-(piperazin-1-ylsulfonylamino)benzamide
CID 61253139
N-[4-(difluoromethylsulfanyl)phenyl]piperazine-1-sulfonamide
CID 61252719
N-[4-(2-methylpropoxy)phenyl]piperazine-1-sulfonamide
CID 84760719
4-[(E)-2-piperazin-1-ylsulfonylethenyl]benzonitrile
CID 22628086
4-(2-piperazin-1-ylsulfonylethenyl)benzonitrile
CID 57296783
(4-cyanophenyl)sulfamic acid
CID 15847253
N-(1-methylpyrazol-4-yl)piperazine-1-sulfonamide
CID 43535244
N-(4-cyanophenyl)-4-[6-(cyclopropylmethylamino)hexoxy]piperidine-1-sulfonamide
CID 91603261
N-[3-(piperazin-1-ylsulfonylamino)phenyl]acetamide
CID 28775811

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)piperazine-1-sulfonamide?
The IUPAC name of N-(4-cyanophenyl)piperazine-1-sulfonamide (CID 28775902) is N-(4-cyanophenyl)piperazine-1-sulfonamide.
What is the SMILES notation for N-(4-cyanophenyl)piperazine-1-sulfonamide?
The canonical SMILES for N-(4-cyanophenyl)piperazine-1-sulfonamide is N#Cc1ccc(NS(=O)(=O)N2CCNCC2)cc1.
What is the InChIKey of N-(4-cyanophenyl)piperazine-1-sulfonamide?
The InChIKey is GLAKRLHAOOBVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c12-9-10-1-3-11(4-2-10)14-18(16,17)15-7-5-13-6-8-15/h1-4,13-14H,5-8H2.
What are the key properties of N-(4-cyanophenyl)piperazine-1-sulfonamide?
N-(4-cyanophenyl)piperazine-1-sulfonamide has a molecular weight of 266.33 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)piperazine-1-sulfonamide is sourced from PubChem (CID 28775902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).