methyl 2-[(2-ethoxyacetyl)amino]acetate

C7H13NO4 — CID 3980701

IUPACmethyl 2-[(2-ethoxyacetyl)amino]acetate
SMILESCCOCC(=O)NCC(=O)OC
InChIInChI=1S/C7H13NO4/c1-3-12-5-6(9)8-4-7(10)11-2/h3-5H2,1-2H3,(H,8,9)
InChIKeyBIOJHTVBFGMOAW-UHFFFAOYSA-N
MW175.18 g/mol
LogP-0.69
Rot. Bonds5

About methyl 2-[(2-ethoxyacetyl)amino]acetate

methyl 2-[(2-ethoxyacetyl)amino]acetate (PubChem CID 3980701) has the molecular formula C7H13NO4 and a molecular weight of 175.18 g/mol. Its IUPAC name is methyl 2-[(2-ethoxyacetyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(2-ethoxyacetyl)amino]acetate
PubChem CID3980701
Molecular FormulaC7H13NO4
Molecular Weight175.18 g/mol
Exact Mass175.08
IUPAC Namemethyl 2-[(2-ethoxyacetyl)amino]acetate
SMILESCCOCC(=O)NCC(=O)OC
InChIInChI=1S/C7H13NO4/c1-3-12-5-6(9)8-4-7(10)11-2/h3-5H2,1-2H3,(H,8,9)
InChIKeyBIOJHTVBFGMOAW-UHFFFAOYSA-N
XLogP-0.69
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.18
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 2-[(2-ethoxyacetyl)amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-ethoxyacetyl)amino]acetate?
The IUPAC name of methyl 2-[(2-ethoxyacetyl)amino]acetate (CID 3980701) is methyl 2-[(2-ethoxyacetyl)amino]acetate.
What is the SMILES notation for methyl 2-[(2-ethoxyacetyl)amino]acetate?
The canonical SMILES for methyl 2-[(2-ethoxyacetyl)amino]acetate is CCOCC(=O)NCC(=O)OC.
What is the InChIKey of methyl 2-[(2-ethoxyacetyl)amino]acetate?
The InChIKey is BIOJHTVBFGMOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO4/c1-3-12-5-6(9)8-4-7(10)11-2/h3-5H2,1-2H3,(H,8,9).
What are the key properties of methyl 2-[(2-ethoxyacetyl)amino]acetate?
methyl 2-[(2-ethoxyacetyl)amino]acetate has a molecular weight of 175.18 g/mol, XLogP of -0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-ethoxyacetyl)amino]acetate is sourced from PubChem (CID 3980701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).