2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone

C18H17F2NO3 — CID 110663877

IUPAC2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(COc1ccccc1F)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C18H17F2NO3/c19-14-7-5-13(6-8-14)16-11-23-10-9-21(16)18(22)12-24-17-4-2-1-3-15(17)20/h1-8,16H,9-12H2
InChIKeyYQXHATDLGMPLSZ-UHFFFAOYSA-N
MW333.33 g/mol
LogP2.94
Rot. Bonds4

About 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone

2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone (PubChem CID 110663877) has the molecular formula C18H17F2NO3 and a molecular weight of 333.33 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
PubChem CID110663877
Molecular FormulaC18H17F2NO3
Molecular Weight333.33 g/mol
Exact Mass333.12
IUPAC Name2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(COc1ccccc1F)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C18H17F2NO3/c19-14-7-5-13(6-8-14)16-11-23-10-9-21(16)18(22)12-24-17-4-2-1-3-15(17)20/h1-8,16H,9-12H2
InChIKeyYQXHATDLGMPLSZ-UHFFFAOYSA-N
XLogP2.94
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.33
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-1-(3-phenylmorpholin-4-yl)ethanone
CID 110728348
2-(4-fluorophenyl)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 110663846
1-[3-(4-fluorophenyl)morpholin-4-yl]-2-(2-methylphenyl)ethanone
CID 110663868
2-[2-[3-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]isoindole-1,3-dione
CID 110663852
2-(2-fluorophenoxy)-1-(2-phenyl-1,3-oxazolidin-3-yl)ethanone
CID 110740351
2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
CID 110728374
1-[3-[(dimethylamino)methyl]morpholin-4-yl]-2-(2-fluorophenoxy)ethanone;formic acid
CID 71785953
1-[3-(4-fluorophenyl)morpholin-4-yl]-3-thiophen-2-ylpropan-1-one
CID 110663863
1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 110663815
1-[3-(4-fluorophenyl)morpholin-4-yl]-2-(1H-indol-3-yl)ethanone
CID 110663792
1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-(2-fluorophenoxy)ethanone
CID 51140306
(4-fluorophenyl)-(3-phenylmorpholin-4-yl)methanone
CID 110728336

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The IUPAC name of 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone (CID 110663877) is 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone is O=C(COc1ccccc1F)N1CCOCC1c1ccc(F)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The InChIKey is YQXHATDLGMPLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2NO3/c19-14-7-5-13(6-8-14)16-11-23-10-9-21(16)18(22)12-24-17-4-2-1-3-15(17)20/h1-8,16H,9-12H2.
What are the key properties of 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone has a molecular weight of 333.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 110663877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).