[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate

C24H23NO6 — CID 8672077

IUPAC[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
SMILESCCOc1ccc(Oc2ccc(NC(=O)COC(=O)Cc3ccc(O)cc3)cc2)cc1
InChIInChI=1S/C24H23NO6/c1-2-29-20-11-13-22(14-12-20)31-21-9-5-18(6-10-21)25-23(27)16-30-24(28)15-17-3-7-19(26)8-4-17/h3-14,26H,2,15-16H2,1H3,(H,25,27)
InChIKeyXINHQGCOICVVHW-UHFFFAOYSA-N
MW421.45 g/mol
LogP4.31
Rot. Bonds9

About [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate

[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate (PubChem CID 8672077) has the molecular formula C24H23NO6 and a molecular weight of 421.45 g/mol. Its IUPAC name is [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate.

Molecular Properties

Compound Name[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
PubChem CID8672077
Molecular FormulaC24H23NO6
Molecular Weight421.45 g/mol
Exact Mass421.15
IUPAC Name[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
SMILESCCOc1ccc(Oc2ccc(NC(=O)COC(=O)Cc3ccc(O)cc3)cc2)cc1
InChIInChI=1S/C24H23NO6/c1-2-29-20-11-13-22(14-12-20)31-21-9-5-18(6-10-21)25-23(27)16-30-24(28)15-17-3-7-19(26)8-4-17/h3-14,26H,2,15-16H2,1H3,(H,25,27)
InChIKeyXINHQGCOICVVHW-UHFFFAOYSA-N
XLogP4.31
TPSA94.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.45
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-oxo-2-(4-phenoxyanilino)ethyl] 2-(4-hydroxyphenyl)acetate
CID 8671886
[2-(4-fluoroanilino)-2-oxoethyl] 2-(4-ethoxyphenyl)acetate
CID 71820864
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672049
methyl 2-[4-[2-(4-ethoxyanilino)-2-oxoethoxy]phenyl]acetate
CID 7695236
[2-oxo-2-(4-phenoxyanilino)ethyl] 2-(4-acetamidophenyl)acetate
CID 8609217
[2-(4-ethoxyanilino)-2-oxoethyl] 2-(4-ethylphenoxy)acetate
CID 9272649
[2-(4-ethoxyanilino)-2-oxoethyl] 4-(4-hydroxyphenyl)benzoate
CID 7133676
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672080
[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] cyclobutanecarboxylate
CID 8019701
[2-oxo-2-(propan-2-ylamino)ethyl] 2-(4-ethoxyphenyl)acetate
CID 71820840
2-(4-ethoxyphenoxy)ethyl 2-(4-acetamidophenyl)acetate
CID 8610737
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 7705523

Frequently Asked Questions

What is the IUPAC name of [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The IUPAC name of [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate (CID 8672077) is [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate.
What is the SMILES notation for [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The canonical SMILES for [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate is CCOc1ccc(Oc2ccc(NC(=O)COC(=O)Cc3ccc(O)cc3)cc2)cc1.
What is the InChIKey of [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
The InChIKey is XINHQGCOICVVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO6/c1-2-29-20-11-13-22(14-12-20)31-21-9-5-18(6-10-21)25-23(27)16-30-24(28)15-17-3-7-19(26)8-4-17/h3-14,26H,2,15-16H2,1H3,(H,25,27).
What are the key properties of [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate?
[2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate has a molecular weight of 421.45 g/mol, XLogP of 4.31, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(4-ethoxyphenoxy)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate is sourced from PubChem (CID 8672077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).