[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate

C24H23NO4 — CID 8920134

IUPAC[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate
SMILESO=C(COC(=O)COc1ccccc1-c1ccccc1)NCCc1ccccc1
InChIInChI=1S/C24H23NO4/c26-23(25-16-15-19-9-3-1-4-10-19)17-29-24(27)18-28-22-14-8-7-13-21(22)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,25,26)
InChIKeyAILUVTHUWYJQRK-UHFFFAOYSA-N
MW389.45 g/mol
LogP3.63
Rot. Bonds9

About [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate

[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate (PubChem CID 8920134) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate.

Molecular Properties

Compound Name[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate
PubChem CID8920134
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate
SMILESO=C(COC(=O)COc1ccccc1-c1ccccc1)NCCc1ccccc1
InChIInChI=1S/C24H23NO4/c26-23(25-16-15-19-9-3-1-4-10-19)17-29-24(27)18-28-22-14-8-7-13-21(22)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,25,26)
InChIKeyAILUVTHUWYJQRK-UHFFFAOYSA-N
XLogP3.63
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-fluorophenoxy)acetate
CID 7842405
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
[2-(ethoxycarbonylamino)-2-oxoethyl] 2-(2-phenylphenoxy)acetate
CID 8919723
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 8913578
[2-(4-methylanilino)-2-oxoethyl] 2-(2-phenylphenoxy)acetate
CID 8920045
[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 2-(4-phenylphenoxy)acetate
CID 9140643
[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 2553995
[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-(2-phenylphenoxy)acetate
CID 8919475
[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 2-phenylbenzoate
CID 7229070
N-[2-[[2-(2-phenylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 51153241
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 2-(2-phenylphenoxy)acetate
CID 8919629
[2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 2-(2-phenylphenoxy)acetate
CID 8920117

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate?
The IUPAC name of [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate (CID 8920134) is [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate.
What is the SMILES notation for [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate?
The canonical SMILES for [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate is O=C(COC(=O)COc1ccccc1-c1ccccc1)NCCc1ccccc1.
What is the InChIKey of [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate?
The InChIKey is AILUVTHUWYJQRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c26-23(25-16-15-19-9-3-1-4-10-19)17-29-24(27)18-28-22-14-8-7-13-21(22)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,25,26).
What are the key properties of [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate?
[2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate has a molecular weight of 389.45 g/mol, XLogP of 3.63, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-phenylethylamino)ethyl] 2-(2-phenylphenoxy)acetate is sourced from PubChem (CID 8920134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).