1-ethylpiperazine-2-sulfonamide

C6H15N3O2S — CID 146020737

IUPAC1-ethylpiperazine-2-sulfonamide
SMILESCCN1CCNCC1S(N)(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-2-9-4-3-8-5-6(9)12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11)
InChIKeyMDCPUJPWTKRUCC-UHFFFAOYSA-N
MW193.27 g/mol
LogP-1.47
Rot. Bonds2

About 1-ethylpiperazine-2-sulfonamide

1-ethylpiperazine-2-sulfonamide (PubChem CID 146020737) has the molecular formula C6H15N3O2S and a molecular weight of 193.27 g/mol. Its IUPAC name is 1-ethylpiperazine-2-sulfonamide.

Molecular Properties

Compound Name1-ethylpiperazine-2-sulfonamide
PubChem CID146020737
Molecular FormulaC6H15N3O2S
Molecular Weight193.27 g/mol
Exact Mass193.09
IUPAC Name1-ethylpiperazine-2-sulfonamide
SMILESCCN1CCNCC1S(N)(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-2-9-4-3-8-5-6(9)12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11)
InChIKeyMDCPUJPWTKRUCC-UHFFFAOYSA-N
XLogP-1.47
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-1.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethylpiperazine-2-sulfonamide?
The IUPAC name of 1-ethylpiperazine-2-sulfonamide (CID 146020737) is 1-ethylpiperazine-2-sulfonamide.
What is the SMILES notation for 1-ethylpiperazine-2-sulfonamide?
The canonical SMILES for 1-ethylpiperazine-2-sulfonamide is CCN1CCNCC1S(N)(=O)=O.
What is the InChIKey of 1-ethylpiperazine-2-sulfonamide?
The InChIKey is MDCPUJPWTKRUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2S/c1-2-9-4-3-8-5-6(9)12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11).
What are the key properties of 1-ethylpiperazine-2-sulfonamide?
1-ethylpiperazine-2-sulfonamide has a molecular weight of 193.27 g/mol, XLogP of -1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylpiperazine-2-sulfonamide is sourced from PubChem (CID 146020737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).