[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate

C24H23NO4 — CID 7489257

IUPAC[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate
SMILESCc1ccccc1CC(=O)OCC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H23NO4/c1-18-7-5-6-10-20(18)15-24(27)29-17-23(26)25-21-11-13-22(14-12-21)28-16-19-8-3-2-4-9-19/h2-14H,15-17H2,1H3,(H,25,26)
InChIKeyQDSCAGSGHQBPQZ-UHFFFAOYSA-N
MW389.45 g/mol
LogP4.30
Rot. Bonds8

About [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate

[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate (PubChem CID 7489257) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate.

Molecular Properties

Compound Name[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate
PubChem CID7489257
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate
SMILESCc1ccccc1CC(=O)OCC(=O)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H23NO4/c1-18-7-5-6-10-20(18)15-24(27)29-17-23(26)25-21-11-13-22(14-12-21)28-16-19-8-3-2-4-9-19/h2-14H,15-17H2,1H3,(H,25,26)
InChIKeyQDSCAGSGHQBPQZ-UHFFFAOYSA-N
XLogP4.30
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 8573191
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-thiophen-2-ylacetate
CID 7799166
[2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 8575023
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(3-methylphenoxy)acetate
CID 7853518
2-(3,4-dimethylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 4947508
2-(2,5-dimethylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 46769353
methyl 3-oxo-3-(4-phenylmethoxyanilino)propanoate
CID 28638020
N-(3,4-dimethylphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 1132550
ethyl 4-oxo-4-(4-phenylmethoxyanilino)butanoate
CID 4947468
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] pyridine-2-carboxylate
CID 7866583
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 4-hydroxybenzoate
CID 2426200
[2-(2-methylanilino)-2-oxoethyl] 2-(2-methylphenyl)acetate
CID 7489270

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate?
The IUPAC name of [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate (CID 7489257) is [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate.
What is the SMILES notation for [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate?
The canonical SMILES for [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate is Cc1ccccc1CC(=O)OCC(=O)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate?
The InChIKey is QDSCAGSGHQBPQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c1-18-7-5-6-10-20(18)15-24(27)29-17-23(26)25-21-11-13-22(14-12-21)28-16-19-8-3-2-4-9-19/h2-14H,15-17H2,1H3,(H,25,26).
What are the key properties of [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate?
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate has a molecular weight of 389.45 g/mol, XLogP of 4.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-(2-methylphenyl)acetate is sourced from PubChem (CID 7489257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).