4-(4-ethenylphenyl)sulfonylmorpholine

C12H15NO3S — CID 175115555

IUPAC4-(4-ethenylphenyl)sulfonylmorpholine
SMILESC=Cc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C12H15NO3S/c1-2-11-3-5-12(6-4-11)17(14,15)13-7-9-16-10-8-13/h2-6H,1,7-10H2
InChIKeyPNBKILVWBWFXMP-UHFFFAOYSA-N
MW253.32 g/mol
LogP1.35
Rot. Bonds3

About 4-(4-ethenylphenyl)sulfonylmorpholine

4-(4-ethenylphenyl)sulfonylmorpholine (PubChem CID 175115555) has the molecular formula C12H15NO3S and a molecular weight of 253.32 g/mol. Its IUPAC name is 4-(4-ethenylphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name4-(4-ethenylphenyl)sulfonylmorpholine
PubChem CID175115555
Molecular FormulaC12H15NO3S
Molecular Weight253.32 g/mol
Exact Mass253.08
IUPAC Name4-(4-ethenylphenyl)sulfonylmorpholine
SMILESC=Cc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C12H15NO3S/c1-2-11-3-5-12(6-4-11)17(14,15)13-7-9-16-10-8-13/h2-6H,1,7-10H2
InChIKeyPNBKILVWBWFXMP-UHFFFAOYSA-N
XLogP1.35
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethenylphenyl)sulfonylmorpholine?
The IUPAC name of 4-(4-ethenylphenyl)sulfonylmorpholine (CID 175115555) is 4-(4-ethenylphenyl)sulfonylmorpholine.
What is the SMILES notation for 4-(4-ethenylphenyl)sulfonylmorpholine?
The canonical SMILES for 4-(4-ethenylphenyl)sulfonylmorpholine is C=Cc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-(4-ethenylphenyl)sulfonylmorpholine?
The InChIKey is PNBKILVWBWFXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3S/c1-2-11-3-5-12(6-4-11)17(14,15)13-7-9-16-10-8-13/h2-6H,1,7-10H2.
What are the key properties of 4-(4-ethenylphenyl)sulfonylmorpholine?
4-(4-ethenylphenyl)sulfonylmorpholine has a molecular weight of 253.32 g/mol, XLogP of 1.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethenylphenyl)sulfonylmorpholine is sourced from PubChem (CID 175115555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).