methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate

C12H15NO4 — CID 3423294

IUPACmethyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate
SMILESCOC(=O)CNC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C12H15NO4/c1-16-10-5-3-9(4-6-10)7-11(14)13-8-12(15)17-2/h3-6H,7-8H2,1-2H3,(H,13,14)
InChIKeyMDAQIMJQOYDWCQ-UHFFFAOYSA-N
MW237.25 g/mol
LogP0.53
Rot. Bonds5

About methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate

methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate (PubChem CID 3423294) has the molecular formula C12H15NO4 and a molecular weight of 237.25 g/mol. Its IUPAC name is methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate
PubChem CID3423294
Molecular FormulaC12H15NO4
Molecular Weight237.25 g/mol
Exact Mass237.10
IUPAC Namemethyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate
SMILESCOC(=O)CNC(=O)Cc1ccc(OC)cc1
InChIInChI=1S/C12H15NO4/c1-16-10-5-3-9(4-6-10)7-11(14)13-8-12(15)17-2/h3-6H,7-8H2,1-2H3,(H,13,14)
InChIKeyMDAQIMJQOYDWCQ-UHFFFAOYSA-N
XLogP0.53
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(ethylamino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 9224356
methyl 2-[[2-(4-chlorophenyl)acetyl]amino]acetate
CID 27682247
N-(2-amino-2-sulfanylideneethyl)-2-(4-methoxyphenyl)acetamide
CID 61127076
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
2-(4-hydroxyphenyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]acetamide
CID 122191191
N-(2-hydroxy-2-methylpropyl)-2-(4-methoxyphenyl)acetamide
CID 65109847
methyl 2-[[2-[(2-phenylacetyl)amino]acetyl]amino]acetate
CID 23345289
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 7826702
[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 9201254
2-(4-methoxyphenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 110712460
2-(4-bromophenyl)-N-[2-(4-methoxyphenyl)-2-oxoethyl]acetamide
CID 108798758
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 110285268

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate?
The IUPAC name of methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate (CID 3423294) is methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate.
What is the SMILES notation for methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate?
The canonical SMILES for methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate is COC(=O)CNC(=O)Cc1ccc(OC)cc1.
What is the InChIKey of methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate?
The InChIKey is MDAQIMJQOYDWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO4/c1-16-10-5-3-9(4-6-10)7-11(14)13-8-12(15)17-2/h3-6H,7-8H2,1-2H3,(H,13,14).
What are the key properties of methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate?
methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate has a molecular weight of 237.25 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate is sourced from PubChem (CID 3423294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).