3-(4-chlorophenyl)sulfonylmorpholine

C10H12ClNO3S — CID 117037142

IUPAC3-(4-chlorophenyl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Cl)cc1)C1COCCN1
InChIInChI=1S/C10H12ClNO3S/c11-8-1-3-9(4-2-8)16(13,14)10-7-15-6-5-12-10/h1-4,10,12H,5-7H2
InChIKeyJYIQBNCPPNAZRF-UHFFFAOYSA-N
MW261.73 g/mol
LogP1.06
Rot. Bonds2

About 3-(4-chlorophenyl)sulfonylmorpholine

3-(4-chlorophenyl)sulfonylmorpholine (PubChem CID 117037142) has the molecular formula C10H12ClNO3S and a molecular weight of 261.73 g/mol. Its IUPAC name is 3-(4-chlorophenyl)sulfonylmorpholine.

Molecular Properties

Compound Name3-(4-chlorophenyl)sulfonylmorpholine
PubChem CID117037142
Molecular FormulaC10H12ClNO3S
Molecular Weight261.73 g/mol
Exact Mass261.02
IUPAC Name3-(4-chlorophenyl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Cl)cc1)C1COCCN1
InChIInChI=1S/C10H12ClNO3S/c11-8-1-3-9(4-2-8)16(13,14)10-7-15-6-5-12-10/h1-4,10,12H,5-7H2
InChIKeyJYIQBNCPPNAZRF-UHFFFAOYSA-N
XLogP1.06
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.73
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)sulfonylmorpholine?
The IUPAC name of 3-(4-chlorophenyl)sulfonylmorpholine (CID 117037142) is 3-(4-chlorophenyl)sulfonylmorpholine.
What is the SMILES notation for 3-(4-chlorophenyl)sulfonylmorpholine?
The canonical SMILES for 3-(4-chlorophenyl)sulfonylmorpholine is O=S(=O)(c1ccc(Cl)cc1)C1COCCN1.
What is the InChIKey of 3-(4-chlorophenyl)sulfonylmorpholine?
The InChIKey is JYIQBNCPPNAZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO3S/c11-8-1-3-9(4-2-8)16(13,14)10-7-15-6-5-12-10/h1-4,10,12H,5-7H2.
What are the key properties of 3-(4-chlorophenyl)sulfonylmorpholine?
3-(4-chlorophenyl)sulfonylmorpholine has a molecular weight of 261.73 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)sulfonylmorpholine is sourced from PubChem (CID 117037142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).