N-methylpiperazine-1-sulfonamide;hydrochloride

C5H14ClN3O2S — CID 86812477

IUPACN-methylpiperazine-1-sulfonamide;hydrochloride
SMILESCNS(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C5H13N3O2S.ClH/c1-6-11(9,10)8-4-2-7-3-5-8;/h6-7H,2-5H2,1H3;1H
InChIKeyKBYGRTBROZYKPX-UHFFFAOYSA-N
MW215.71 g/mol
LogP-1.22
Rot. Bonds2

About N-methylpiperazine-1-sulfonamide;hydrochloride

N-methylpiperazine-1-sulfonamide;hydrochloride (PubChem CID 86812477) has the molecular formula C5H14ClN3O2S and a molecular weight of 215.71 g/mol. Its IUPAC name is N-methylpiperazine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-methylpiperazine-1-sulfonamide;hydrochloride
PubChem CID86812477
Molecular FormulaC5H14ClN3O2S
Molecular Weight215.71 g/mol
Exact Mass215.05
IUPAC NameN-methylpiperazine-1-sulfonamide;hydrochloride
SMILESCNS(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C5H13N3O2S.ClH/c1-6-11(9,10)8-4-2-7-3-5-8;/h6-7H,2-5H2,1H3;1H
InChIKeyKBYGRTBROZYKPX-UHFFFAOYSA-N
XLogP-1.22
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.71
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-methylazocane-1-sulfonamide
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1-methylsulfonylpiperazine
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CID 64733123
N-(2,4,4-trimethylpentan-2-yl)piperazine-1-sulfonamide
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N-(2-methylsulfanylethyl)piperazine-1-sulfonamide
CID 63958312
1-piperazin-1-ylsulfonyl-3-propan-2-ylurea
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Frequently Asked Questions

What is the IUPAC name of N-methylpiperazine-1-sulfonamide;hydrochloride?
The IUPAC name of N-methylpiperazine-1-sulfonamide;hydrochloride (CID 86812477) is N-methylpiperazine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-methylpiperazine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-methylpiperazine-1-sulfonamide;hydrochloride is CNS(=O)(=O)N1CCNCC1.Cl.
What is the InChIKey of N-methylpiperazine-1-sulfonamide;hydrochloride?
The InChIKey is KBYGRTBROZYKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3O2S.ClH/c1-6-11(9,10)8-4-2-7-3-5-8;/h6-7H,2-5H2,1H3;1H.
What are the key properties of N-methylpiperazine-1-sulfonamide;hydrochloride?
N-methylpiperazine-1-sulfonamide;hydrochloride has a molecular weight of 215.71 g/mol, XLogP of -1.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpiperazine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 86812477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).