2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone

C14H20N2O3 — CID 16772853

IUPAC2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2N)CC(C)O1
InChIInChI=1S/C14H20N2O3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3
InChIKeyBCUFZEANWXSETJ-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.28
Rot. Bonds3

About 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone

2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 16772853) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID16772853
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)COc2ccccc2N)CC(C)O1
InChIInChI=1S/C14H20N2O3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3
InChIKeyBCUFZEANWXSETJ-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

2-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethoxy]benzamide
CID 7283920
2-(2-chlorophenoxy)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanone
CID 973581
methyl 2-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxoethoxy]benzoate
CID 2445011
N-[2-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethoxy]phenyl]acetamide
CID 7867396
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-(2-hydroxyphenoxy)ethanone
CID 102934123
2-(2-aminophenoxy)-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 43544132
2-[2-(aminomethyl)phenoxy]-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 102931538
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(4-phenylphenoxy)ethanone
CID 27233616
2-(2-aminophenyl)sulfanyl-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 43248979
2-(2-aminophenoxy)-1-(4-ethylpiperidin-1-yl)ethanone
CID 61115282
2-(2-aminophenoxy)-1-[3-(methoxymethyl)pyrrolidin-1-yl]ethanone
CID 64570188
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]ethanone
CID 8551244

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 16772853) is 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)COc2ccccc2N)CC(C)O1.
What is the InChIKey of 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is BCUFZEANWXSETJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-7-16(8-11(2)19-10)14(17)9-18-13-6-4-3-5-12(13)15/h3-6,10-11H,7-9,15H2,1-2H3.
What are the key properties of 2-(2-aminophenoxy)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
2-(2-aminophenoxy)-1-(2,6-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-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 16772853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).