ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate

C18H19NO3 — CID 163761967

IUPACethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate
SMILESCCOC(=O)CNC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H19NO3/c1-2-22-18(21)13-19-17(20)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,19,20)
InChIKeyLYYJGUBOEUVNEG-UHFFFAOYSA-N
MW297.35 g/mol
LogP2.58
Rot. Bonds6

About ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate

ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate (PubChem CID 163761967) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate
PubChem CID163761967
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Nameethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate
SMILESCCOC(=O)CNC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H19NO3/c1-2-22-18(21)13-19-17(20)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,19,20)
InChIKeyLYYJGUBOEUVNEG-UHFFFAOYSA-N
XLogP2.58
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-phenylphenyl)methyl 2-[(2-phenylacetyl)amino]acetate
CID 7826713
ethyl 2-[[2-(2-methylphenyl)acetyl]amino]acetate
CID 26163301
benzyl 2-[(2-phenylacetyl)amino]acetate
CID 2168453
ethyl 2-(4-phenylphenyl)acetate;2-(2-phenylphenyl)acetic acid
CID 70442423
ethyl 2-[(2-pyridin-2-ylacetyl)amino]acetate
CID 55026375
ethyl N-[(4-phenylphenyl)methyl]carbamate
CID 90935573
N-(2-methoxyethyl)-2-(4-phenylphenyl)acetamide
CID 2094675
ethyl 2-[(2-thiophen-2-ylacetyl)amino]acetate
CID 4632592
ethyl 2-phenylacetate
CID 7590
ethyl propanoate;2-[(4-phenylbenzoyl)amino]acetic acid
CID 143394399
methyl 2-[[2-[(2-phenylacetyl)amino]acetyl]amino]acetate
CID 23345289
[2-(4-ethylanilino)-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 8524003

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate?
The IUPAC name of ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate (CID 163761967) is ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate?
The canonical SMILES for ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate is CCOC(=O)CNC(=O)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate?
The InChIKey is LYYJGUBOEUVNEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-2-22-18(21)13-19-17(20)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,19,20).
What are the key properties of ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate?
ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate has a molecular weight of 297.35 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2-(4-phenylphenyl)acetyl]amino]acetate is sourced from PubChem (CID 163761967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).