4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine

C14H19NO3S — CID 10945886

IUPAC4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine
SMILESO=S(=O)(/C=C/CCc1ccccc1)N1CCOCC1
InChIInChI=1S/C14H19NO3S/c16-19(17,15-9-11-18-12-10-15)13-5-4-8-14-6-2-1-3-7-14/h1-3,5-7,13H,4,8-12H2/b13-5+
InChIKeyJKJFAHAJVTYKOV-WLRTZDKTSA-N
MW281.38 g/mol
LogP1.79
Rot. Bonds5

About 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine

4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine (PubChem CID 10945886) has the molecular formula C14H19NO3S and a molecular weight of 281.38 g/mol. Its IUPAC name is 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine
PubChem CID10945886
Molecular FormulaC14H19NO3S
Molecular Weight281.38 g/mol
Exact Mass281.11
IUPAC Name4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine
SMILESO=S(=O)(/C=C/CCc1ccccc1)N1CCOCC1
InChIInChI=1S/C14H19NO3S/c16-19(17,15-9-11-18-12-10-15)13-5-4-8-14-6-2-1-3-7-14/h1-3,5-7,13H,4,8-12H2/b13-5+
InChIKeyJKJFAHAJVTYKOV-WLRTZDKTSA-N
XLogP1.79
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 560201
bis(4-(2-benzylphenyl)sulfonylmorpholine);sulfane
CID 68565404
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CID 110706002
4-[3-[(4-benzylpiperazin-1-yl)methyl]phenyl]sulfonylmorpholine
CID 8902409
methane;4-(2-phenylethyl)morpholine
CID 143698819
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-4-phenylbutanamide
CID 55704601
4-[3-(4-benzylpiperidin-1-yl)sulfonylphenyl]sulfonylmorpholine
CID 651778
N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide
CID 38543627
N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
CID 1164401
4-(benzenesulfonyl)morpholine;ethane
CID 143200179
1-[(E)-2-phenylethenyl]sulfonylpyrrolidine
CID 18624669
dilithium;4-benzylmorpholine;sulfite
CID 160525639

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine?
The IUPAC name of 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine (CID 10945886) is 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine.
What is the SMILES notation for 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine?
The canonical SMILES for 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine is O=S(=O)(/C=C/CCc1ccccc1)N1CCOCC1.
What is the InChIKey of 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine?
The InChIKey is JKJFAHAJVTYKOV-WLRTZDKTSA-N. The full InChI is InChI=1S/C14H19NO3S/c16-19(17,15-9-11-18-12-10-15)13-5-4-8-14-6-2-1-3-7-14/h1-3,5-7,13H,4,8-12H2/b13-5+.
What are the key properties of 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine?
4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine has a molecular weight of 281.38 g/mol, XLogP of 1.79, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine is sourced from PubChem (CID 10945886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).