2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine

C18H20ClNO3S — CID 110327021

IUPAC2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine
SMILESCCc1ccc(S(=O)(=O)N2CCOC(c3cccc(Cl)c3)C2)cc1
InChIInChI=1S/C18H20ClNO3S/c1-2-14-6-8-17(9-7-14)24(21,22)20-10-11-23-18(13-20)15-4-3-5-16(19)12-15/h3-9,12,18H,2,10-11,13H2,1H3
InChIKeyGLULGXFFELFITP-UHFFFAOYSA-N
MW365.88 g/mol
LogP3.66
Rot. Bonds4

About 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine

2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine (PubChem CID 110327021) has the molecular formula C18H20ClNO3S and a molecular weight of 365.88 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine
PubChem CID110327021
Molecular FormulaC18H20ClNO3S
Molecular Weight365.88 g/mol
Exact Mass365.09
IUPAC Name2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine
SMILESCCc1ccc(S(=O)(=O)N2CCOC(c3cccc(Cl)c3)C2)cc1
InChIInChI=1S/C18H20ClNO3S/c1-2-14-6-8-17(9-7-14)24(21,22)20-10-11-23-18(13-20)15-4-3-5-16(19)12-15/h3-9,12,18H,2,10-11,13H2,1H3
InChIKeyGLULGXFFELFITP-UHFFFAOYSA-N
XLogP3.66
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.88
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(benzenesulfonyl)-2-(4-ethylphenyl)morpholine
CID 110364047
2-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)sulfonylmorpholine
CID 110327027
2-(3-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)morpholine
CID 110327031
(2S)-4-(3-chlorophenyl)sulfonyl-2-phenylmorpholine
CID 51696505
4-(4-ethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327245
2-(4-ethylphenyl)-4-(3-nitrophenyl)sulfonylmorpholine
CID 110364088
2-(3-chlorophenyl)-N-methylmorpholine-4-sulfonamide
CID 110609461
2-(3-chlorophenyl)-N-propylmorpholine-4-sulfonamide
CID 110609463
4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-(4-ethylphenyl)morpholine
CID 110364061
1-[4-[2-(3,5-dichlorophenyl)morpholin-4-yl]sulfonylphenyl]ethanone
CID 121134630
1-[(3-chlorophenyl)methyl]-4-(4-ethylphenyl)sulfonylpiperazine
CID 17378936
2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine?
The IUPAC name of 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine (CID 110327021) is 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine.
What is the SMILES notation for 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine?
The canonical SMILES for 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine is CCc1ccc(S(=O)(=O)N2CCOC(c3cccc(Cl)c3)C2)cc1.
What is the InChIKey of 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine?
The InChIKey is GLULGXFFELFITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO3S/c1-2-14-6-8-17(9-7-14)24(21,22)20-10-11-23-18(13-20)15-4-3-5-16(19)12-15/h3-9,12,18H,2,10-11,13H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine?
2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine has a molecular weight of 365.88 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-4-(4-ethylphenyl)sulfonylmorpholine is sourced from PubChem (CID 110327021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).