2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one

C15H18FNO4 — CID 63067650

IUPAC2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCC(=O)c1ccc(F)cc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C15H18FNO4/c1-10(18)13-4-3-12(16)9-14(13)21-11(2)15(19)17-5-7-20-8-6-17/h3-4,9,11H,5-8H2,1-2H3
InChIKeyOJDZHXRNGSXDDZ-UHFFFAOYSA-N
MW295.31 g/mol
LogP1.65
Rot. Bonds4

About 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one

2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one (PubChem CID 63067650) has the molecular formula C15H18FNO4 and a molecular weight of 295.31 g/mol. Its IUPAC name is 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
PubChem CID63067650
Molecular FormulaC15H18FNO4
Molecular Weight295.31 g/mol
Exact Mass295.12
IUPAC Name2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCC(=O)c1ccc(F)cc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C15H18FNO4/c1-10(18)13-4-3-12(16)9-14(13)21-11(2)15(19)17-5-7-20-8-6-17/h3-4,9,11H,5-8H2,1-2H3
InChIKeyOJDZHXRNGSXDDZ-UHFFFAOYSA-N
XLogP1.65
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 43083116
2-(2-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 60627807
2-(3,4-difluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 78767959
5-bromo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)oxybenzoic acid
CID 43084682
2-(2-acetyl-5-fluorophenoxy)-N,N-dimethylpropanamide
CID 55148420
2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 43143211
2-[5-fluoro-2-[(1R)-1-hydroxyethyl]phenoxy]-1-piperidin-1-ylpropan-1-one
CID 78934249
2-[5-fluoro-2-(1-hydroxyethyl)phenoxy]-1-piperidin-1-ylpropan-1-one
CID 63067677
2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
CID 43505242
1-(azepan-1-yl)-2-(2-bromo-4-fluorophenoxy)propan-1-one
CID 43086571
3-bromo-4-(1-morpholin-4-yl-1-oxopropan-2-yl)oxybenzaldehyde
CID 60643504
2-[4-chloro-2-(1-hydroxyethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 62074940

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one (CID 63067650) is 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one is CC(=O)c1ccc(F)cc1OC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one?
The InChIKey is OJDZHXRNGSXDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO4/c1-10(18)13-4-3-12(16)9-14(13)21-11(2)15(19)17-5-7-20-8-6-17/h3-4,9,11H,5-8H2,1-2H3.
What are the key properties of 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one?
2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one has a molecular weight of 295.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 63067650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).