[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate

C20H22N2O5 — CID 7826702

IUPAC[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
SMILESCOc1ccc(CNC(=O)COC(=O)CNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C20H22N2O5/c1-26-17-9-7-16(8-10-17)12-21-19(24)14-27-20(25)13-22-18(23)11-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,21,24)(H,22,23)
InChIKeySMFLQWARLWXHOE-UHFFFAOYSA-N
MW370.41 g/mol
LogP1.21
Rot. Bonds9

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

[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate (PubChem CID 7826702) has the molecular formula C20H22N2O5 and a molecular weight of 370.41 g/mol. Its IUPAC name is [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate.

Molecular Properties

Compound Name[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
PubChem CID7826702
Molecular FormulaC20H22N2O5
Molecular Weight370.41 g/mol
Exact Mass370.15
IUPAC Name[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
SMILESCOc1ccc(CNC(=O)COC(=O)CNC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C20H22N2O5/c1-26-17-9-7-16(8-10-17)12-21-19(24)14-27-20(25)13-22-18(23)11-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,21,24)(H,22,23)
InChIKeySMFLQWARLWXHOE-UHFFFAOYSA-N
XLogP1.21
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 40692952
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-benzamidoacetate
CID 2625536
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-(4-methylpentanoylamino)acetate
CID 56519933
methyl 2-[[2-(4-methoxyphenyl)acetyl]amino]acetate
CID 3423294
[2-(2,5-dimethoxyanilino)-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 8523973
[2-(2,4-dimethoxyanilino)-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 8523284
[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 9201254
[2-(benzylamino)-2-oxoethyl] 2-[(4-phenoxybenzoyl)amino]acetate
CID 7833383
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-benzylbenzoate
CID 2587645
[2-(3-methoxyanilino)-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate
CID 8523970
[2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 9201290

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate?
The IUPAC name of [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate (CID 7826702) is [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate.
What is the SMILES notation for [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate?
The canonical SMILES for [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate is COc1ccc(CNC(=O)COC(=O)CNC(=O)Cc2ccccc2)cc1.
What is the InChIKey of [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate?
The InChIKey is SMFLQWARLWXHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O5/c1-26-17-9-7-16(8-10-17)12-21-19(24)14-27-20(25)13-22-18(23)11-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,21,24)(H,22,23).
What are the key properties of [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate?
[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate has a molecular weight of 370.41 g/mol, XLogP of 1.21, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methoxyphenyl)methylamino]-2-oxoethyl] 2-[(2-phenylacetyl)amino]acetate is sourced from PubChem (CID 7826702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).