2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one

C15H19NO4 — CID 43083116

IUPAC2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCC(=O)c1ccccc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C15H19NO4/c1-11(17)13-5-3-4-6-14(13)20-12(2)15(18)16-7-9-19-10-8-16/h3-6,12H,7-10H2,1-2H3
InChIKeyICTQWZDUYKHHKK-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.52
Rot. Bonds4

About 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one

2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one (PubChem CID 43083116) has the molecular formula C15H19NO4 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one
PubChem CID43083116
Molecular FormulaC15H19NO4
Molecular Weight277.32 g/mol
Exact Mass277.13
IUPAC Name2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCC(=O)c1ccccc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C15H19NO4/c1-11(17)13-5-3-4-6-14(13)20-12(2)15(18)16-7-9-19-10-8-16/h3-6,12H,7-10H2,1-2H3
InChIKeyICTQWZDUYKHHKK-UHFFFAOYSA-N
XLogP1.52
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 63067650
2-(2-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 60627807
2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 43143211
5-bromo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)oxybenzoic acid
CID 43084682
3-(2-acetylphenoxy)butan-2-one
CID 82312052
(2S)-1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
CID 734825
(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
CID 92679202
(2S)-2-(3-chlorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 898248
2-(3-iodophenoxy)-1-morpholin-4-ylpropan-1-one
CID 21101274
1-morpholin-4-yl-2-[4-[2-(4-phenylphenoxy)propanoyl]piperazin-1-yl]ethane-1,2-dione
CID 55607691
2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
CID 43505242
2-[4-(1-hydroxyethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 43503667

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one (CID 43083116) is 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one is CC(=O)c1ccccc1OC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one?
The InChIKey is ICTQWZDUYKHHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO4/c1-11(17)13-5-3-4-6-14(13)20-12(2)15(18)16-7-9-19-10-8-16/h3-6,12H,7-10H2,1-2H3.
What are the key properties of 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one?
2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one has a molecular weight of 277.32 g/mol, XLogP of 1.52, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 43083116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).