ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate

C19H21NO4 — CID 724647

IUPACethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)COc1ccccc1CC
InChIInChI=1S/C19H21NO4/c1-3-14-9-5-8-12-17(14)24-13-18(21)20-16-11-7-6-10-15(16)19(22)23-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyLEABJDRPDYRBES-UHFFFAOYSA-N
MW327.38 g/mol
LogP3.44
Rot. Bonds7

About ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate

ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate (PubChem CID 724647) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate.

Molecular Properties

Compound Nameethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate
PubChem CID724647
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Nameethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)COc1ccccc1CC
InChIInChI=1S/C19H21NO4/c1-3-14-9-5-8-12-17(14)24-13-18(21)20-16-11-7-6-10-15(16)19(22)23-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyLEABJDRPDYRBES-UHFFFAOYSA-N
XLogP3.44
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[2-(2-ethylphenoxy)acetyl]amino]-2-hydroxybenzoate
CID 56543416
ethyl 2-(propanoylamino)benzoate
CID 4190428
ethyl 2-[[(2S)-2-(2-ethylphenoxy)propanoyl]amino]benzoate
CID 92685092
ethyl 2-[[2-[4-(4-methylphenyl)phenoxy]acetyl]amino]benzoate
CID 19172378
ethyl 2-[[2-(2-acetyl-4-chlorophenoxy)acetyl]amino]benzoate
CID 7167831
ethyl 2-[[2-(2-aminophenyl)acetyl]amino]benzoate
CID 28712736
2-[2-(2-ethoxycarbonylanilino)-2-oxoethoxy]acetic acid
CID 60662085
ethyl 2-[[2-(2-chloro-4-phenylphenoxy)acetyl]amino]benzoate
CID 7653195
ethyl 2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoate
CID 682452
ethyl 2-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]benzoate
CID 19171971
2-[[2-(2-methylphenoxy)acetyl]amino]benzamide
CID 4268113
ethyl 2-[[2-(2-tert-butyl-4-methoxyphenoxy)acetyl]amino]benzoate
CID 35270938

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate?
The IUPAC name of ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate (CID 724647) is ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate.
What is the SMILES notation for ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate?
The canonical SMILES for ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate is CCOC(=O)c1ccccc1NC(=O)COc1ccccc1CC.
What is the InChIKey of ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate?
The InChIKey is LEABJDRPDYRBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c1-3-14-9-5-8-12-17(14)24-13-18(21)20-16-11-7-6-10-15(16)19(22)23-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,21).
What are the key properties of ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate?
ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate has a molecular weight of 327.38 g/mol, XLogP of 3.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2-(2-ethylphenoxy)acetyl]amino]benzoate is sourced from PubChem (CID 724647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).