4-piperazin-1-ylsulfonylmorpholine;hydrochloride

C8H18ClN3O3S — CID 42883596

IUPAC4-piperazin-1-ylsulfonylmorpholine;hydrochloride
SMILESCl.O=S(=O)(N1CCNCC1)N1CCOCC1
InChIInChI=1S/C8H17N3O3S.ClH/c12-15(13,10-3-1-9-2-4-10)11-5-7-14-8-6-11;/h9H,1-8H2;1H
InChIKeyRGPGMLOCLXQVBM-UHFFFAOYSA-N
MW271.77 g/mol
LogP-1.11
Rot. Bonds2

About 4-piperazin-1-ylsulfonylmorpholine;hydrochloride

4-piperazin-1-ylsulfonylmorpholine;hydrochloride (PubChem CID 42883596) has the molecular formula C8H18ClN3O3S and a molecular weight of 271.77 g/mol. Its IUPAC name is 4-piperazin-1-ylsulfonylmorpholine;hydrochloride.

Molecular Properties

Compound Name4-piperazin-1-ylsulfonylmorpholine;hydrochloride
PubChem CID42883596
Molecular FormulaC8H18ClN3O3S
Molecular Weight271.77 g/mol
Exact Mass271.08
IUPAC Name4-piperazin-1-ylsulfonylmorpholine;hydrochloride
SMILESCl.O=S(=O)(N1CCNCC1)N1CCOCC1
InChIInChI=1S/C8H17N3O3S.ClH/c12-15(13,10-3-1-9-2-4-10)11-5-7-14-8-6-11;/h9H,1-8H2;1H
InChIKeyRGPGMLOCLXQVBM-UHFFFAOYSA-N
XLogP-1.11
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.77
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The IUPAC name of 4-piperazin-1-ylsulfonylmorpholine;hydrochloride (CID 42883596) is 4-piperazin-1-ylsulfonylmorpholine;hydrochloride.
What is the SMILES notation for 4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The canonical SMILES for 4-piperazin-1-ylsulfonylmorpholine;hydrochloride is Cl.O=S(=O)(N1CCNCC1)N1CCOCC1.
What is the InChIKey of 4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The InChIKey is RGPGMLOCLXQVBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3S.ClH/c12-15(13,10-3-1-9-2-4-10)11-5-7-14-8-6-11;/h9H,1-8H2;1H.
What are the key properties of 4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
4-piperazin-1-ylsulfonylmorpholine;hydrochloride has a molecular weight of 271.77 g/mol, XLogP of -1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperazin-1-ylsulfonylmorpholine;hydrochloride is sourced from PubChem (CID 42883596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).