[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate

C17H16O5 — CID 7811189

IUPAC[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
SMILESCOc1ccccc1C(=O)COC(=O)c1ccccc1OC
InChIInChI=1S/C17H16O5/c1-20-15-9-5-3-7-12(15)14(18)11-22-17(19)13-8-4-6-10-16(13)21-2/h3-10H,11H2,1-2H3
InChIKeyXRTNPCWCHQBVJF-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.74
Rot. Bonds6

About [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate

[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate (PubChem CID 7811189) has the molecular formula C17H16O5 and a molecular weight of 300.31 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
PubChem CID7811189
Molecular FormulaC17H16O5
Molecular Weight300.31 g/mol
Exact Mass300.10
IUPAC Name[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
SMILESCOc1ccccc1C(=O)COC(=O)c1ccccc1OC
InChIInChI=1S/C17H16O5/c1-20-15-9-5-3-7-12(15)14(18)11-22-17(19)13-8-4-6-10-16(13)21-2/h3-10H,11H2,1-2H3
InChIKeyXRTNPCWCHQBVJF-UHFFFAOYSA-N
XLogP2.74
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate 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-(2-methoxyphenyl)-2-oxoethyl] 4-methoxynaphthalene-1-carboxylate
CID 8596344
[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
CID 40565888
[2-(2-methoxyphenyl)-2-oxoethyl] 4-bromobenzoate
CID 2357062
[2-(2-methoxyphenyl)-2-oxoethyl] 2-hydroxy-5-methoxybenzoate
CID 18155883
[2-(2-methoxyphenyl)-2-oxoethyl] 2-chloropyridine-3-carboxylate
CID 7867502
[2-(2-methoxyphenyl)-2-oxoethyl] 2-(phenoxymethyl)benzoate
CID 7949326
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
CID 7626940
[2-(2-methoxyphenyl)-2-oxoethyl] 4-acetyl-1H-pyrrole-2-carboxylate
CID 9385606
[3-(2-methoxybenzoyl)oxy-2,2-bis[(2-methoxybenzoyl)oxymethyl]propyl] 2-methoxybenzoate
CID 54498561
[2-(2-methoxyphenyl)-2-oxoethyl] 2-amino-5-nitrobenzoate
CID 7990093
[2-(2-methoxyphenyl)-2-oxoethyl] 5-methylpyrazine-2-carboxylate
CID 8634442

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate?
The IUPAC name of [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate (CID 7811189) is [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate.
What is the SMILES notation for [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate?
The canonical SMILES for [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate is COc1ccccc1C(=O)COC(=O)c1ccccc1OC.
What is the InChIKey of [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate?
The InChIKey is XRTNPCWCHQBVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O5/c1-20-15-9-5-3-7-12(15)14(18)11-22-17(19)13-8-4-6-10-16(13)21-2/h3-10H,11H2,1-2H3.
What are the key properties of [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate?
[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate has a molecular weight of 300.31 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate is sourced from PubChem (CID 7811189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).