1-piperidin-1-ylsulfonylpiperazine;hydrochloride

C9H20ClN3O2S — CID 56965519

IUPAC1-piperidin-1-ylsulfonylpiperazine;hydrochloride
SMILESCl.O=S(=O)(N1CCCCC1)N1CCNCC1
InChIInChI=1S/C9H19N3O2S.ClH/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12;/h10H,1-9H2;1H
InChIKeyXTTMAWNYOFMWRX-UHFFFAOYSA-N
MW269.80 g/mol
LogP0.04
Rot. Bonds2

About 1-piperidin-1-ylsulfonylpiperazine;hydrochloride

1-piperidin-1-ylsulfonylpiperazine;hydrochloride (PubChem CID 56965519) has the molecular formula C9H20ClN3O2S and a molecular weight of 269.80 g/mol. Its IUPAC name is 1-piperidin-1-ylsulfonylpiperazine;hydrochloride.

Molecular Properties

Compound Name1-piperidin-1-ylsulfonylpiperazine;hydrochloride
PubChem CID56965519
Molecular FormulaC9H20ClN3O2S
Molecular Weight269.80 g/mol
Exact Mass269.10
IUPAC Name1-piperidin-1-ylsulfonylpiperazine;hydrochloride
SMILESCl.O=S(=O)(N1CCCCC1)N1CCNCC1
InChIInChI=1S/C9H19N3O2S.ClH/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12;/h10H,1-9H2;1H
InChIKeyXTTMAWNYOFMWRX-UHFFFAOYSA-N
XLogP0.04
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.80
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Piperidine;piperidine-1-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-ylsulfonylpiperazine;hydrochloride?
The IUPAC name of 1-piperidin-1-ylsulfonylpiperazine;hydrochloride (CID 56965519) is 1-piperidin-1-ylsulfonylpiperazine;hydrochloride.
What is the SMILES notation for 1-piperidin-1-ylsulfonylpiperazine;hydrochloride?
The canonical SMILES for 1-piperidin-1-ylsulfonylpiperazine;hydrochloride is Cl.O=S(=O)(N1CCCCC1)N1CCNCC1.
What is the InChIKey of 1-piperidin-1-ylsulfonylpiperazine;hydrochloride?
The InChIKey is XTTMAWNYOFMWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2S.ClH/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12;/h10H,1-9H2;1H.
What are the key properties of 1-piperidin-1-ylsulfonylpiperazine;hydrochloride?
1-piperidin-1-ylsulfonylpiperazine;hydrochloride has a molecular weight of 269.80 g/mol, XLogP of 0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-ylsulfonylpiperazine;hydrochloride is sourced from PubChem (CID 56965519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).