[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol

C12H24N2O4S — CID 54878650

IUPAC[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol
SMILESCC1CN(S(=O)(=O)N2CCC(CO)CC2)CC(C)O1
InChIInChI=1S/C12H24N2O4S/c1-10-7-14(8-11(2)18-10)19(16,17)13-5-3-12(9-15)4-6-13/h10-12,15H,3-9H2,1-2H3
InChIKeyMITOCQFLNJLVIH-UHFFFAOYSA-N
MW292.40 g/mol
LogP0.04
Rot. Bonds3

About [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol

[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol (PubChem CID 54878650) has the molecular formula C12H24N2O4S and a molecular weight of 292.40 g/mol. Its IUPAC name is [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol
PubChem CID54878650
Molecular FormulaC12H24N2O4S
Molecular Weight292.40 g/mol
Exact Mass292.15
IUPAC Name[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol
SMILESCC1CN(S(=O)(=O)N2CCC(CO)CC2)CC(C)O1
InChIInChI=1S/C12H24N2O4S/c1-10-7-14(8-11(2)18-10)19(16,17)13-5-3-12(9-15)4-6-13/h10-12,15H,3-9H2,1-2H3
InChIKeyMITOCQFLNJLVIH-UHFFFAOYSA-N
XLogP0.04
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpyrrolidin-3-amine
CID 124572808
2,6-dimethyl-4-piperazin-1-ylsulfonylmorpholine;hydrochloride
CID 119961532
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-methylpiperidine-4-carboxamide
CID 94018098
1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-methylpiperidine-4-carboxamide
CID 94018099
(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-[4-(hydroxymethyl)piperidin-1-yl]sulfonylpiperidine-4-carboxylic acid
CID 60858430
1-(2,6-dimethylmorpholin-4-yl)-2-[4-(hydroxymethyl)piperidin-1-yl]ethanone
CID 60768713
4-(chloromethyl)-1-(3,4-dimethylpyrrolidin-1-yl)sulfonylpiperidine
CID 79183603
1-[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-2-methylpropan-2-amine
CID 120847809
(2S)-2-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylpiperazin-1-yl]propanoic acid
CID 125149387
1-[4-(hydroxymethyl)piperidin-1-yl]sulfonylpiperidine-3-carboxylic acid
CID 60858591

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol?
The IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol (CID 54878650) is [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol.
What is the SMILES notation for [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol?
The canonical SMILES for [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol is CC1CN(S(=O)(=O)N2CCC(CO)CC2)CC(C)O1.
What is the InChIKey of [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol?
The InChIKey is MITOCQFLNJLVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O4S/c1-10-7-14(8-11(2)18-10)19(16,17)13-5-3-12(9-15)4-6-13/h10-12,15H,3-9H2,1-2H3.
What are the key properties of [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol?
[1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol has a molecular weight of 292.40 g/mol, XLogP of 0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylmorpholin-4-yl)sulfonylpiperidin-4-yl]methanol is sourced from PubChem (CID 54878650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).