2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride

C10H22ClN3O3S — CID 119961532

IUPAC2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride
SMILESCC1CN(S(=O)(=O)N2CCNCC2)CC(C)O1.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-9-7-13(8-10(2)16-9)17(14,15)12-5-3-11-4-6-12;/h9-11H,3-8H2,1-2H3;1H
InChIKeyQYRWGFVCFNUXQB-UHFFFAOYSA-N
MW299.82 g/mol
LogP-0.33
Rot. Bonds2

About 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride

2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride (PubChem CID 119961532) has the molecular formula C10H22ClN3O3S and a molecular weight of 299.82 g/mol. Its IUPAC name is 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride.

Molecular Properties

Compound Name2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride
PubChem CID119961532
Molecular FormulaC10H22ClN3O3S
Molecular Weight299.82 g/mol
Exact Mass299.11
IUPAC Name2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride
SMILESCC1CN(S(=O)(=O)N2CCNCC2)CC(C)O1.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-9-7-13(8-10(2)16-9)17(14,15)12-5-3-11-4-6-12;/h9-11H,3-8H2,1-2H3;1H
InChIKeyQYRWGFVCFNUXQB-UHFFFAOYSA-N
XLogP-0.33
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.82
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-4-(2-methylpiperazin-1-yl)sulfonylmorpholine;hydrochloride
CID 119969720
1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylpiperazine
CID 28775925
4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-2-one
CID 42936453
1-piperazin-1-ylsulfonylazetidin-3-ol;hydrochloride
CID 138039753
[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol
CID 54878650
[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-pyrrolidin-3-ylmethanone;hydrochloride
CID 119730759
(3S,4R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-3,4-diol
CID 79410684
1-(2,6-dimethylmorpholin-4-yl)sulfonyl-4-methylpiperidin-4-ol
CID 81103434
1-(3-methylpiperidin-1-yl)sulfonylpiperazine;hydrochloride
CID 119961883
4-(2,3-dimethylpiperazin-1-yl)sulfonyl-2,6-dimethylmorpholine
CID 120725700
1,2-dimethyl-4-piperazin-1-ylsulfonylpiperazine
CID 63608690
(3R)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpyrrolidin-3-amine
CID 124572808

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The IUPAC name of 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride (CID 119961532) is 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride.
What is the SMILES notation for 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The canonical SMILES for 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride is CC1CN(S(=O)(=O)N2CCNCC2)CC(C)O1.Cl.
What is the InChIKey of 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
The InChIKey is QYRWGFVCFNUXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S.ClH/c1-9-7-13(8-10(2)16-9)17(14,15)12-5-3-11-4-6-12;/h9-11H,3-8H2,1-2H3;1H.
What are the key properties of 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride?
2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride has a molecular weight of 299.82 g/mol, XLogP of -0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride is sourced from PubChem (CID 119961532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).