4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine

C12H24N2O4S — CID 47025304

IUPAC4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine
SMILESCC1CN(S(=O)(=O)N2CC(C)OC(C)C2)C(C)CO1
InChIInChI=1S/C12H24N2O4S/c1-9-8-17-10(2)7-14(9)19(15,16)13-5-11(3)18-12(4)6-13/h9-12H,5-8H2,1-4H3
InChIKeyQPCZQJZSIGMGRE-UHFFFAOYSA-N
MW292.40 g/mol
LogP0.45
Rot. Bonds2

About 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine

4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine (PubChem CID 47025304) has the molecular formula C12H24N2O4S and a molecular weight of 292.40 g/mol. Its IUPAC name is 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine
PubChem CID47025304
Molecular FormulaC12H24N2O4S
Molecular Weight292.40 g/mol
Exact Mass292.15
IUPAC Name4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine
SMILESCC1CN(S(=O)(=O)N2CC(C)OC(C)C2)C(C)CO1
InChIInChI=1S/C12H24N2O4S/c1-9-8-17-10(2)7-14(9)19(15,16)13-5-11(3)18-12(4)6-13/h9-12H,5-8H2,1-4H3
InChIKeyQPCZQJZSIGMGRE-UHFFFAOYSA-N
XLogP0.45
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine?
The IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine (CID 47025304) is 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine.
What is the SMILES notation for 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine?
The canonical SMILES for 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine is CC1CN(S(=O)(=O)N2CC(C)OC(C)C2)C(C)CO1.
What is the InChIKey of 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine?
The InChIKey is QPCZQJZSIGMGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O4S/c1-9-8-17-10(2)7-14(9)19(15,16)13-5-11(3)18-12(4)6-13/h9-12H,5-8H2,1-4H3.
What are the key properties of 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine?
4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine has a molecular weight of 292.40 g/mol, XLogP of 0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylmorpholin-4-yl)sulfonyl-2,6-dimethylmorpholine is sourced from PubChem (CID 47025304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).