1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone

C21H25NO3 — CID 110364025

IUPAC1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
SMILESCCc1ccc(C2CN(C(=O)COc3ccc(C)cc3)CCO2)cc1
InChIInChI=1S/C21H25NO3/c1-3-17-6-8-18(9-7-17)20-14-22(12-13-24-20)21(23)15-25-19-10-4-16(2)5-11-19/h4-11,20H,3,12-15H2,1-2H3
InChIKeyZGYNWFYOVNCMLM-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.54
Rot. Bonds5

About 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone

1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone (PubChem CID 110364025) has the molecular formula C21H25NO3 and a molecular weight of 339.44 g/mol. Its IUPAC name is 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone.

Molecular Properties

Compound Name1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
PubChem CID110364025
Molecular FormulaC21H25NO3
Molecular Weight339.44 g/mol
Exact Mass339.18
IUPAC Name1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
SMILESCCc1ccc(C2CN(C(=O)COc3ccc(C)cc3)CCO2)cc1
InChIInChI=1S/C21H25NO3/c1-3-17-6-8-18(9-7-17)20-14-22(12-13-24-20)21(23)15-25-19-10-4-16(2)5-11-19/h4-11,20H,3,12-15H2,1-2H3
InChIKeyZGYNWFYOVNCMLM-UHFFFAOYSA-N
XLogP3.54
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-tert-butylphenoxy)-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134838
2-(3-methoxyphenoxy)-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134803
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-(4-propoxyphenoxy)ethanone
CID 60552824
1-[2-(4-ethylphenyl)morpholin-4-yl]-4-phenoxybutan-1-one
CID 110364018
2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
CID 25281339
2-(4-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 25281342
1-[2-(4-ethyl-1,2,4-triazol-3-yl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone
CID 129006398
(4-ethoxyphenyl)-[2-(4-methylphenyl)morpholin-4-yl]methanone
CID 121134773
1-[2-(4-ethylphenyl)morpholin-4-yl]ethanone
CID 71684128
2-(4-methylphenoxy)-1-[(2S)-2-[(4-methylphenoxy)methyl]morpholin-4-yl]ethanone
CID 92757449
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
4-[2-oxo-2-[(2R)-2-phenylmorpholin-4-yl]ethoxy]benzamide
CID 94796760

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone?
The IUPAC name of 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone (CID 110364025) is 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone.
What is the SMILES notation for 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone?
The canonical SMILES for 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone is CCc1ccc(C2CN(C(=O)COc3ccc(C)cc3)CCO2)cc1.
What is the InChIKey of 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone?
The InChIKey is ZGYNWFYOVNCMLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO3/c1-3-17-6-8-18(9-7-17)20-14-22(12-13-24-20)21(23)15-25-19-10-4-16(2)5-11-19/h4-11,20H,3,12-15H2,1-2H3.
What are the key properties of 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone?
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone has a molecular weight of 339.44 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-methylphenoxy)ethanone is sourced from PubChem (CID 110364025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).