4-piperidin-4-ylsulfonylmorpholine;hydrochloride

C9H19ClN2O3S — CID 66617675

IUPAC4-piperidin-4-ylsulfonylmorpholine;hydrochloride
SMILESCl.O=S(=O)(C1CCNCC1)N1CCOCC1
InChIInChI=1S/C9H18N2O3S.ClH/c12-15(13,9-1-3-10-4-2-9)11-5-7-14-8-6-11;/h9-10H,1-8H2;1H
InChIKeyCGPVKOCIKOSPIL-UHFFFAOYSA-N
MW270.78 g/mol
LogP-0.18
Rot. Bonds2

About 4-piperidin-4-ylsulfonylmorpholine;hydrochloride

4-piperidin-4-ylsulfonylmorpholine;hydrochloride (PubChem CID 66617675) has the molecular formula C9H19ClN2O3S and a molecular weight of 270.78 g/mol. Its IUPAC name is 4-piperidin-4-ylsulfonylmorpholine;hydrochloride.

Molecular Properties

Compound Name4-piperidin-4-ylsulfonylmorpholine;hydrochloride
PubChem CID66617675
Molecular FormulaC9H19ClN2O3S
Molecular Weight270.78 g/mol
Exact Mass270.08
IUPAC Name4-piperidin-4-ylsulfonylmorpholine;hydrochloride
SMILESCl.O=S(=O)(C1CCNCC1)N1CCOCC1
InChIInChI=1S/C9H18N2O3S.ClH/c12-15(13,9-1-3-10-4-2-9)11-5-7-14-8-6-11;/h9-10H,1-8H2;1H
InChIKeyCGPVKOCIKOSPIL-UHFFFAOYSA-N
XLogP-0.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.78
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-piperidin-4-ylsulfonylmorpholine;hydrochloride?
The IUPAC name of 4-piperidin-4-ylsulfonylmorpholine;hydrochloride (CID 66617675) is 4-piperidin-4-ylsulfonylmorpholine;hydrochloride.
What is the SMILES notation for 4-piperidin-4-ylsulfonylmorpholine;hydrochloride?
The canonical SMILES for 4-piperidin-4-ylsulfonylmorpholine;hydrochloride is Cl.O=S(=O)(C1CCNCC1)N1CCOCC1.
What is the InChIKey of 4-piperidin-4-ylsulfonylmorpholine;hydrochloride?
The InChIKey is CGPVKOCIKOSPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S.ClH/c12-15(13,9-1-3-10-4-2-9)11-5-7-14-8-6-11;/h9-10H,1-8H2;1H.
What are the key properties of 4-piperidin-4-ylsulfonylmorpholine;hydrochloride?
4-piperidin-4-ylsulfonylmorpholine;hydrochloride has a molecular weight of 270.78 g/mol, XLogP of -0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-4-ylsulfonylmorpholine;hydrochloride is sourced from PubChem (CID 66617675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).