N,N-dimethylpiperazine-1-sulfonamide;hydrochloride

C6H16ClN3O2S — CID 22031678

IUPACN,N-dimethylpiperazine-1-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C6H15N3O2S.ClH/c1-8(2)12(10,11)9-5-3-7-4-6-9;/h7H,3-6H2,1-2H3;1H
InChIKeyHLSJHTCIYSDJIF-UHFFFAOYSA-N
MW229.73 g/mol
LogP-0.88
Rot. Bonds2

About N,N-dimethylpiperazine-1-sulfonamide;hydrochloride

N,N-dimethylpiperazine-1-sulfonamide;hydrochloride (PubChem CID 22031678) has the molecular formula C6H16ClN3O2S and a molecular weight of 229.73 g/mol. Its IUPAC name is N,N-dimethylpiperazine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN,N-dimethylpiperazine-1-sulfonamide;hydrochloride
PubChem CID22031678
Molecular FormulaC6H16ClN3O2S
Molecular Weight229.73 g/mol
Exact Mass229.07
IUPAC NameN,N-dimethylpiperazine-1-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C6H15N3O2S.ClH/c1-8(2)12(10,11)9-5-3-7-4-6-9;/h7H,3-6H2,1-2H3;1H
InChIKeyHLSJHTCIYSDJIF-UHFFFAOYSA-N
XLogP-0.88
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.73
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpiperazine-1-sulfonamide;hydrochloride?
The IUPAC name of N,N-dimethylpiperazine-1-sulfonamide;hydrochloride (CID 22031678) is N,N-dimethylpiperazine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N,N-dimethylpiperazine-1-sulfonamide;hydrochloride?
The canonical SMILES for N,N-dimethylpiperazine-1-sulfonamide;hydrochloride is CN(C)S(=O)(=O)N1CCNCC1.Cl.
What is the InChIKey of N,N-dimethylpiperazine-1-sulfonamide;hydrochloride?
The InChIKey is HLSJHTCIYSDJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2S.ClH/c1-8(2)12(10,11)9-5-3-7-4-6-9;/h7H,3-6H2,1-2H3;1H.
What are the key properties of N,N-dimethylpiperazine-1-sulfonamide;hydrochloride?
N,N-dimethylpiperazine-1-sulfonamide;hydrochloride has a molecular weight of 229.73 g/mol, XLogP of -0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpiperazine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 22031678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).