(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate

C20H20FNO5 — CID 47009421

IUPAC(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate
SMILESO=C(COc1ccc(F)cc1)OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H20FNO5/c21-16-6-8-17(9-7-16)26-14-18(23)27-19(15-4-2-1-3-5-15)20(24)22-10-12-25-13-11-22/h1-9,19H,10-14H2
InChIKeySNHZXBVHKAAAFR-UHFFFAOYSA-N
MW373.38 g/mol
LogP2.35
Rot. Bonds6

About (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate

(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate (PubChem CID 47009421) has the molecular formula C20H20FNO5 and a molecular weight of 373.38 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate
PubChem CID47009421
Molecular FormulaC20H20FNO5
Molecular Weight373.38 g/mol
Exact Mass373.13
IUPAC Name(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate
SMILESO=C(COc1ccc(F)cc1)OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H20FNO5/c21-16-6-8-17(9-7-16)26-14-18(23)27-19(15-4-2-1-3-5-15)20(24)22-10-12-25-13-11-22/h1-9,19H,10-14H2
InChIKeySNHZXBVHKAAAFR-UHFFFAOYSA-N
XLogP2.35
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.38
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(4-ethoxyphenoxy)acetate
CID 7704937
[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(2-chloro-4-fluorophenoxy)acetate
CID 8639042
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(4-phenylmethoxyphenoxy)acetate
CID 55317024
[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(4-chlorophenyl)acetate
CID 7699782
1-morpholin-4-ylpropan-2-yl 2-(4-fluorophenoxy)acetate
CID 649208
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-(trifluoromethoxy)benzoate
CID 51110252
2-(4-fluorophenoxy)-N-[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl]acetamide
CID 94822842
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methoxybenzoate
CID 18198778
[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 4-[[(2R)-oxolan-2-yl]methoxy]benzoate
CID 7705762
[(1R)-2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl] acetate
CID 7272419
[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl] acetate
CID 2930820
[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(2-oxo-1,3-thiazolidin-3-yl)acetate
CID 7632606

Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate?
The IUPAC name of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate (CID 47009421) is (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate.
What is the SMILES notation for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate?
The canonical SMILES for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate is O=C(COc1ccc(F)cc1)OC(C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate?
The InChIKey is SNHZXBVHKAAAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO5/c21-16-6-8-17(9-7-16)26-14-18(23)27-19(15-4-2-1-3-5-15)20(24)22-10-12-25-13-11-22/h1-9,19H,10-14H2.
What are the key properties of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate?
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate has a molecular weight of 373.38 g/mol, XLogP of 2.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-(4-fluorophenoxy)acetate is sourced from PubChem (CID 47009421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).