4-(benzenesulfonyl)morpholine;ethane

C12H19NO3S — CID 143200179

IUPAC4-(benzenesulfonyl)morpholine;ethane
SMILESCC.O=S(=O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C10H13NO3S.C2H6/c12-15(13,10-4-2-1-3-5-10)11-6-8-14-9-7-11;1-2/h1-5H,6-9H2;1-2H3
InChIKeyQPQFDWIJYCADIZ-UHFFFAOYSA-N
MW257.35 g/mol
LogP1.73
Rot. Bonds2

About 4-(benzenesulfonyl)morpholine;ethane

4-(benzenesulfonyl)morpholine;ethane (PubChem CID 143200179) has the molecular formula C12H19NO3S and a molecular weight of 257.35 g/mol. Its IUPAC name is 4-(benzenesulfonyl)morpholine;ethane.

Molecular Properties

Compound Name4-(benzenesulfonyl)morpholine;ethane
PubChem CID143200179
Molecular FormulaC12H19NO3S
Molecular Weight257.35 g/mol
Exact Mass257.11
IUPAC Name4-(benzenesulfonyl)morpholine;ethane
SMILESCC.O=S(=O)(c1ccccc1)N1CCOCC1
InChIInChI=1S/C10H13NO3S.C2H6/c12-15(13,10-4-2-1-3-5-10)11-6-8-14-9-7-11;1-2/h1-5H,6-9H2;1-2H3
InChIKeyQPQFDWIJYCADIZ-UHFFFAOYSA-N
XLogP1.73
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododecane
CID 1101145
4-[3-(3-morpholin-4-ylsulfonylphenyl)sulfonylphenyl]sulfonylmorpholine
CID 2054799
4-[[1-(benzenesulfonyl)piperidin-4-yl]methyl]morpholine
CID 110284722
4-(4-methylsulfanylphenyl)sulfonylmorpholine
CID 967774
N-benzhydryl-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 1168367
N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylmethanimine
CID 968608
N-(3-morpholin-4-ylsulfonylphenyl)benzenesulfonamide
CID 6469836
N-methyl-3-morpholin-4-ylsulfonylbenzenesulfonamide
CID 49236430
N-benzyl-N-ethyl-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 1167021
4-[3-[(4-benzylpiperazin-1-yl)methyl]phenyl]sulfonylmorpholine
CID 8902409
4-[5-(benzenesulfonyl)-2-methylphenyl]sulfonylmorpholine
CID 1097196
4,7-bis-(4-methylphenyl)sulfonyl-1,4,7-oxadiazecane
CID 13148160

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonyl)morpholine;ethane?
The IUPAC name of 4-(benzenesulfonyl)morpholine;ethane (CID 143200179) is 4-(benzenesulfonyl)morpholine;ethane.
What is the SMILES notation for 4-(benzenesulfonyl)morpholine;ethane?
The canonical SMILES for 4-(benzenesulfonyl)morpholine;ethane is CC.O=S(=O)(c1ccccc1)N1CCOCC1.
What is the InChIKey of 4-(benzenesulfonyl)morpholine;ethane?
The InChIKey is QPQFDWIJYCADIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S.C2H6/c12-15(13,10-4-2-1-3-5-10)11-6-8-14-9-7-11;1-2/h1-5H,6-9H2;1-2H3.
What are the key properties of 4-(benzenesulfonyl)morpholine;ethane?
4-(benzenesulfonyl)morpholine;ethane has a molecular weight of 257.35 g/mol, XLogP of 1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonyl)morpholine;ethane is sourced from PubChem (CID 143200179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).