N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide

C16H22N2O4 — CID 4779699

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide
SMILESCC1CN(C(=O)CNC(=O)COc2ccccc2)CC(C)O1
InChIInChI=1S/C16H22N2O4/c1-12-9-18(10-13(2)22-12)16(20)8-17-15(19)11-21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,17,19)
InChIKeyNNCQESXTVYIYMK-UHFFFAOYSA-N
MW306.36 g/mol
LogP0.82
Rot. Bonds5

About N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide

N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide (PubChem CID 4779699) has the molecular formula C16H22N2O4 and a molecular weight of 306.36 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide
PubChem CID4779699
Molecular FormulaC16H22N2O4
Molecular Weight306.36 g/mol
Exact Mass306.16
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide
SMILESCC1CN(C(=O)CNC(=O)COc2ccccc2)CC(C)O1
InChIInChI=1S/C16H22N2O4/c1-12-9-18(10-13(2)22-12)16(20)8-17-15(19)11-21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,17,19)
InChIKeyNNCQESXTVYIYMK-UHFFFAOYSA-N
XLogP0.82
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide (CID 4779699) is N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide is CC1CN(C(=O)CNC(=O)COc2ccccc2)CC(C)O1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide?
The InChIKey is NNCQESXTVYIYMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4/c1-12-9-18(10-13(2)22-12)16(20)8-17-15(19)11-21-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,17,19).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide?
N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide has a molecular weight of 306.36 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-2-phenoxyacetamide is sourced from PubChem (CID 4779699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).