[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate

C19H19NO6 — CID 2357312

IUPAC[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
SMILESCOc1ccc(C(=O)COC(=O)CNC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H19NO6/c1-24-15-7-3-13(4-8-15)17(21)12-26-18(22)11-20-19(23)14-5-9-16(25-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,20,23)
InChIKeyZMDBSUPDFXNRKQ-UHFFFAOYSA-N
MW357.36 g/mol
LogP1.86
Rot. Bonds8

About [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate

[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate (PubChem CID 2357312) has the molecular formula C19H19NO6 and a molecular weight of 357.36 g/mol. Its IUPAC name is [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate.

Molecular Properties

Compound Name[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
PubChem CID2357312
Molecular FormulaC19H19NO6
Molecular Weight357.36 g/mol
Exact Mass357.12
IUPAC Name[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
SMILESCOc1ccc(C(=O)COC(=O)CNC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H19NO6/c1-24-15-7-3-13(4-8-15)17(21)12-26-18(22)11-20-19(23)14-5-9-16(25-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,20,23)
InChIKeyZMDBSUPDFXNRKQ-UHFFFAOYSA-N
XLogP1.86
TPSA90.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.36
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate?
The IUPAC name of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate (CID 2357312) is [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate.
What is the SMILES notation for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate?
The canonical SMILES for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate is COc1ccc(C(=O)COC(=O)CNC(=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate?
The InChIKey is ZMDBSUPDFXNRKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO6/c1-24-15-7-3-13(4-8-15)17(21)12-26-18(22)11-20-19(23)14-5-9-16(25-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,20,23).
What are the key properties of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate?
[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate has a molecular weight of 357.36 g/mol, XLogP of 1.86, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate is sourced from PubChem (CID 2357312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).