4-(p-Tolylsulfinyl)morpholine

C11H15NO2S — CID 12277337

IUPAC4-(4-methylphenyl)sulfinylmorpholine
SMILESCC1=CC=C(C=C1)S(=O)N2CCOCC2
InChIInChI=1S/C11H15NO2S/c1-10-2-4-11(5-3-10)15(13)12-6-8-14-9-7-12/h2-5H,6-9H2,1H3
InChIKeyCDZKKWTUOUWMAN-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.60
Rot. Bonds2

About 4-(p-Tolylsulfinyl)morpholine

4-(p-Tolylsulfinyl)morpholine (PubChem CID 12277337) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 4-(4-methylphenyl)sulfinylmorpholine.

Molecular Properties

Compound Name4-(p-Tolylsulfinyl)morpholine
PubChem CID12277337
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name4-(4-methylphenyl)sulfinylmorpholine
SMILESCC1=CC=C(C=C1)S(=O)N2CCOCC2
InChIInChI=1S/C11H15NO2S/c1-10-2-4-11(5-3-10)15(13)12-6-8-14-9-7-12/h2-5H,6-9H2,1H3
InChIKeyCDZKKWTUOUWMAN-UHFFFAOYSA-N
XLogP1.60
TPSA48.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity221

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-((4-Methylphenyl)sulphonyl)morpholine
CID 80645
Morpholine, 4-methylbenzenesulfonate (1:1)
CID 83691
2,6-Dimethyl-4-{[3-(trifluoromethyl)phenyl]sulfonyl}morpholine
CID 2818577
4-(2-Phenyl-ethenesulfonyl)-morpholine
CID 1144752
1-Morpholino-2-(p-toluenesulfonyl)aminoethane
CID 567713
4-(Phenylsulfonyl)morpholine
CID 95050
4-[4-[2-(3-Fluorophenyl)ethynyl]phenyl]sulfonylmorpholine
CID 60210914
3-(Toluene-4-sulfonyl)-[1,3]oxazinane
CID 959536
4-(4-Fluoro-3-methylphenyl)sulfonylmorpholine
CID 977826
4-(4-Biphenylylsulfonyl)morpholine
CID 823364
4-{[2-(Trifluoromethyl)phenyl]sulfonyl}morpholine
CID 697921
[4-(Morpholine-4-sulfonyl)phenyl]methanamine
CID 4962072

Frequently Asked Questions

What is the IUPAC name of 4-(p-Tolylsulfinyl)morpholine?
The IUPAC name of 4-(p-Tolylsulfinyl)morpholine (CID 12277337) is 4-(4-methylphenyl)sulfinylmorpholine.
What is the SMILES notation for 4-(p-Tolylsulfinyl)morpholine?
The canonical SMILES for 4-(p-Tolylsulfinyl)morpholine is CC1=CC=C(C=C1)S(=O)N2CCOCC2.
What is the InChIKey of 4-(p-Tolylsulfinyl)morpholine?
The InChIKey is CDZKKWTUOUWMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-10-2-4-11(5-3-10)15(13)12-6-8-14-9-7-12/h2-5H,6-9H2,1H3.
What are the key properties of 4-(p-Tolylsulfinyl)morpholine?
4-(p-Tolylsulfinyl)morpholine has a molecular weight of 225.31 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(p-Tolylsulfinyl)morpholine is sourced from PubChem (CID 12277337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).