4-(3-methoxyphenyl)sulfonylmorpholine

C11H15NO4S — CID 890650

IUPAC4-(3-methoxyphenyl)sulfonylmorpholine
SMILESCOc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C11H15NO4S/c1-15-10-3-2-4-11(9-10)17(13,14)12-5-7-16-8-6-12/h2-4,9H,5-8H2,1H3
InChIKeyQEVQDHLMPDUVKB-UHFFFAOYSA-N
MW257.31 g/mol
LogP0.72
Rot. Bonds3

About 4-(3-methoxyphenyl)sulfonylmorpholine

4-(3-methoxyphenyl)sulfonylmorpholine (PubChem CID 890650) has the molecular formula C11H15NO4S and a molecular weight of 257.31 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)sulfonylmorpholine
PubChem CID890650
Molecular FormulaC11H15NO4S
Molecular Weight257.31 g/mol
Exact Mass257.07
IUPAC Name4-(3-methoxyphenyl)sulfonylmorpholine
SMILESCOc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C11H15NO4S/c1-15-10-3-2-4-11(9-10)17(13,14)12-5-7-16-8-6-12/h2-4,9H,5-8H2,1H3
InChIKeyQEVQDHLMPDUVKB-UHFFFAOYSA-N
XLogP0.72
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)sulfonylmorpholine?
The IUPAC name of 4-(3-methoxyphenyl)sulfonylmorpholine (CID 890650) is 4-(3-methoxyphenyl)sulfonylmorpholine.
What is the SMILES notation for 4-(3-methoxyphenyl)sulfonylmorpholine?
The canonical SMILES for 4-(3-methoxyphenyl)sulfonylmorpholine is COc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)sulfonylmorpholine?
The InChIKey is QEVQDHLMPDUVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4S/c1-15-10-3-2-4-11(9-10)17(13,14)12-5-7-16-8-6-12/h2-4,9H,5-8H2,1H3.
What are the key properties of 4-(3-methoxyphenyl)sulfonylmorpholine?
4-(3-methoxyphenyl)sulfonylmorpholine has a molecular weight of 257.31 g/mol, XLogP of 0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)sulfonylmorpholine is sourced from PubChem (CID 890650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).