2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone

C14H20N2O3 — CID 43544132

IUPAC2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2N)C(C)CO1
InChIInChI=1S/C14H20N2O3/c1-10-8-18-11(2)7-16(10)14(17)9-19-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3
InChIKeyXLLJJSGJKBZVEA-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.28
Rot. Bonds3

About 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone

2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone (PubChem CID 43544132) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone
PubChem CID43544132
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2N)C(C)CO1
InChIInChI=1S/C14H20N2O3/c1-10-8-18-11(2)7-16(10)14(17)9-19-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3
InChIKeyXLLJJSGJKBZVEA-UHFFFAOYSA-N
XLogP1.28
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(2,5-dimethylmorpholin-4-yl)-2-(2-fluorophenoxy)ethanone
CID 110727665
1-(2,5-dimethylmorpholin-4-yl)-2-(4-fluorophenoxy)ethanone
CID 110727667
2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 16772853
4-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethoxy]benzenecarbothioamide
CID 43544825
2-[2-(2,5-dimethylmorpholin-4-yl)ethoxy]aniline
CID 43544167
(2,5-dimethylmorpholin-4-yl)-(2-methoxyphenyl)methanone
CID 110727631
4-[2-(2-aminophenoxy)acetyl]-3-methylpiperazin-2-one
CID 55217652
2-(2-aminophenoxy)-1-[3-(methoxymethyl)pyrrolidin-1-yl]ethanone
CID 64570188
1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-2-methylsulfanylethanone
CID 94053964
1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-2-methylsulfanylethanone
CID 94053963
2-[4-(aminomethyl)phenyl]-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 55213909
2-(2-aminophenoxy)-1-(3-methylsulfonylthiomorpholin-4-yl)ethanone
CID 66381773

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone (CID 43544132) is 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)COc2ccccc2N)C(C)CO1.
What is the InChIKey of 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
The InChIKey is XLLJJSGJKBZVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-8-18-11(2)7-16(10)14(17)9-19-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3.
What are the key properties of 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone?
2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone has a molecular weight of 264.32 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 43544132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).