2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone

C13H16FNO3 — CID 94527179

IUPAC2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone
SMILESC[C@@H]1CN(C(=O)COc2ccc(F)cc2)CCO1
InChIInChI=1S/C13H16FNO3/c1-10-8-15(6-7-17-10)13(16)9-18-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3/t10-/m1/s1
InChIKeyCHHGHXZNPBTGNN-SNVBAGLBSA-N
MW253.27 g/mol
LogP1.45
Rot. Bonds3

About 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone

2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone (PubChem CID 94527179) has the molecular formula C13H16FNO3 and a molecular weight of 253.27 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone
PubChem CID94527179
Molecular FormulaC13H16FNO3
Molecular Weight253.27 g/mol
Exact Mass253.11
IUPAC Name2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone
SMILESC[C@@H]1CN(C(=O)COc2ccc(F)cc2)CCO1
InChIInChI=1S/C13H16FNO3/c1-10-8-15(6-7-17-10)13(16)9-18-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3/t10-/m1/s1
InChIKeyCHHGHXZNPBTGNN-SNVBAGLBSA-N
XLogP1.45
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(4-fluorobenzoyl)phenoxy]-1-[(2S)-2-methylmorpholin-4-yl]ethanone
CID 30036278
2-(4-chlorophenoxy)-1-(2-methylmorpholin-4-yl)ethanone
CID 52985807
N-[4-[2-(2-methylmorpholin-4-yl)-2-oxoethoxy]phenyl]acetamide
CID 51293775
2-(4-fluorophenoxy)-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 829809
2-(4-fluorophenoxy)-1-[2-[(4-methylphenoxy)methyl]morpholin-4-yl]ethanone
CID 129316369
1-[(2R)-2-methylmorpholin-4-yl]-2-(4-pyridin-2-yloxyphenoxy)ethanone
CID 36629682
2-(4-fluorophenoxy)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone
CID 110663787
2-fluoro-6-[2-(2-methylmorpholin-4-yl)-2-oxoethoxy]benzoic acid
CID 107014045
1-[(2S)-2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-2-(4-fluorophenoxy)ethanone
CID 125012935
1-[2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-2-(4-fluorophenoxy)ethanone
CID 110116012
2-[4-(aminomethyl)phenoxy]-1-(2-methyl-1,4-oxazepan-4-yl)ethanone
CID 62988279
1-(3,4-dimethylpiperazin-1-yl)-2-(4-fluorophenoxy)ethanone
CID 110707653

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone?
The IUPAC name of 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone (CID 94527179) is 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone is C[C@@H]1CN(C(=O)COc2ccc(F)cc2)CCO1.
What is the InChIKey of 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone?
The InChIKey is CHHGHXZNPBTGNN-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16FNO3/c1-10-8-15(6-7-17-10)13(16)9-18-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3/t10-/m1/s1.
What are the key properties of 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone?
2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone has a molecular weight of 253.27 g/mol, XLogP of 1.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-1-[(2R)-2-methylmorpholin-4-yl]ethanone is sourced from PubChem (CID 94527179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).