2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one

C20H20FNO4 — CID 17399202

IUPAC2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one
SMILESCC(Oc1ccc(C(=O)c2ccc(F)cc2)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C20H20FNO4/c1-14(20(24)22-10-12-25-13-11-22)26-18-8-4-16(5-9-18)19(23)15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3
InChIKeyUHESTYATSBZLSC-UHFFFAOYSA-N
MW357.38 g/mol
LogP2.68
Rot. Bonds5

About 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one

2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one (PubChem CID 17399202) has the molecular formula C20H20FNO4 and a molecular weight of 357.38 g/mol. Its IUPAC name is 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one
PubChem CID17399202
Molecular FormulaC20H20FNO4
Molecular Weight357.38 g/mol
Exact Mass357.14
IUPAC Name2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one
SMILESCC(Oc1ccc(C(=O)c2ccc(F)cc2)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C20H20FNO4/c1-14(20(24)22-10-12-25-13-11-22)26-18-8-4-16(5-9-18)19(23)15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3
InChIKeyUHESTYATSBZLSC-UHFFFAOYSA-N
XLogP2.68
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.38
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one (CID 17399202) is 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one is CC(Oc1ccc(C(=O)c2ccc(F)cc2)cc1)C(=O)N1CCOCC1.
What is the InChIKey of 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one?
The InChIKey is UHESTYATSBZLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO4/c1-14(20(24)22-10-12-25-13-11-22)26-18-8-4-16(5-9-18)19(23)15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3.
What are the key properties of 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one?
2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one has a molecular weight of 357.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorobenzoyl)phenoxy]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 17399202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).