piperazine-1-sulfonamide

C4H11N3O2S — CID 11252198

IUPACpiperazine-1-sulfonamide
SMILESNS(=O)(=O)N1CCNCC1
InChIInChI=1S/C4H11N3O2S/c5-10(8,9)7-3-1-6-2-4-7/h6H,1-4H2,(H2,5,8,9)
InChIKeyDWXLVZSMXXCSMJ-UHFFFAOYSA-N
MW165.22 g/mol
LogP-1.90
Rot. Bonds1

About piperazine-1-sulfonamide

piperazine-1-sulfonamide (PubChem CID 11252198) has the molecular formula C4H11N3O2S and a molecular weight of 165.22 g/mol. Its IUPAC name is piperazine-1-sulfonamide.

Molecular Properties

Compound Namepiperazine-1-sulfonamide
PubChem CID11252198
Molecular FormulaC4H11N3O2S
Molecular Weight165.22 g/mol
Exact Mass165.06
IUPAC Namepiperazine-1-sulfonamide
SMILESNS(=O)(=O)N1CCNCC1
InChIInChI=1S/C4H11N3O2S/c5-10(8,9)7-3-1-6-2-4-7/h6H,1-4H2,(H2,5,8,9)
InChIKeyDWXLVZSMXXCSMJ-UHFFFAOYSA-N
XLogP-1.90
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 5-1.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of piperazine-1-sulfonamide?
The IUPAC name of piperazine-1-sulfonamide (CID 11252198) is piperazine-1-sulfonamide.
What is the SMILES notation for piperazine-1-sulfonamide?
The canonical SMILES for piperazine-1-sulfonamide is NS(=O)(=O)N1CCNCC1.
What is the InChIKey of piperazine-1-sulfonamide?
The InChIKey is DWXLVZSMXXCSMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O2S/c5-10(8,9)7-3-1-6-2-4-7/h6H,1-4H2,(H2,5,8,9).
What are the key properties of piperazine-1-sulfonamide?
piperazine-1-sulfonamide has a molecular weight of 165.22 g/mol, XLogP of -1.90, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine-1-sulfonamide is sourced from PubChem (CID 11252198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).