2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid

C15H20N2O6 — CID 119348186

IUPAC2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C15H20N2O6/c1-22-8-7-17(10-15(20)21)14(19)9-16-13(18)11-23-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,16,18)(H,20,21)
InChIKeyBJNHTVFKHMNBGI-UHFFFAOYSA-N
MW324.33 g/mol
LogP-0.26
Rot. Bonds10

About 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid

2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid (PubChem CID 119348186) has the molecular formula C15H20N2O6 and a molecular weight of 324.33 g/mol. Its IUPAC name is 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid
PubChem CID119348186
Molecular FormulaC15H20N2O6
Molecular Weight324.33 g/mol
Exact Mass324.13
IUPAC Name2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C15H20N2O6/c1-22-8-7-17(10-15(20)21)14(19)9-16-13(18)11-23-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,16,18)(H,20,21)
InChIKeyBJNHTVFKHMNBGI-UHFFFAOYSA-N
XLogP-0.26
TPSA105.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.33
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2-[(2-aminoacetyl)amino]acetyl]-(2-methoxyethyl)amino]acetic acid
CID 79269851
2-[2-methoxyethyl-[2-[(2-naphthalen-1-ylacetyl)amino]acetyl]amino]acetic acid
CID 119189085
3-[carboxymethyl-(2-phenoxyacetyl)amino]propanoic acid
CID 82325257
N-benzyl-2-[(2-phenoxyacetyl)amino]-N-propylacetamide
CID 30586947
2-[carboxymethyl-(2-phenoxyacetyl)amino]acetic acid
CID 63651467
2-[[4-(2-amino-2-oxoethoxy)benzoyl]-(2-methoxyethyl)amino]acetic acid
CID 119189503
2-[2-methoxyethyl-[2-(3-nitrophenoxy)acetyl]amino]acetic acid
CID 119188944
N-methyl-N-(2-methylpropyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 47163246
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
2-amino-N-[2-[2-methoxyethyl(pyridin-2-ylmethyl)amino]-2-oxoethyl]acetamide
CID 60954047
[2-[[2-(dimethylamino)-2-oxoethyl]amino]-2-oxoethyl] 2-phenoxyacetate
CID 9018336
N-benzyl-2-[(2-phenoxyacetyl)amino]-N-propan-2-ylacetamide
CID 112995071

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid?
The IUPAC name of 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid (CID 119348186) is 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid.
What is the SMILES notation for 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid?
The canonical SMILES for 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid is COCCN(CC(=O)O)C(=O)CNC(=O)COc1ccccc1.
What is the InChIKey of 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid?
The InChIKey is BJNHTVFKHMNBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O6/c1-22-8-7-17(10-15(20)21)14(19)9-16-13(18)11-23-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,16,18)(H,20,21).
What are the key properties of 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid?
2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid has a molecular weight of 324.33 g/mol, XLogP of -0.26, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl-[2-[(2-phenoxyacetyl)amino]acetyl]amino]acetic acid is sourced from PubChem (CID 119348186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).