ethyl 2-(2-methoxyethylamino)acetate

C7H15NO3 — CID 15818815

IUPACethyl 2-(2-methoxyethylamino)acetate
SMILESCCOC(=O)CNCCOC
InChIInChI=1S/C7H15NO3/c1-3-11-7(9)6-8-4-5-10-2/h8H,3-6H2,1-2H3
InChIKeyCAFRQFYFJDTUNI-UHFFFAOYSA-N
MW161.20 g/mol
LogP-0.21
Rot. Bonds6

About ethyl 2-(2-methoxyethylamino)acetate

ethyl 2-(2-methoxyethylamino)acetate (PubChem CID 15818815) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is ethyl 2-(2-methoxyethylamino)acetate.

Molecular Properties

Compound Nameethyl 2-(2-methoxyethylamino)acetate
PubChem CID15818815
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Nameethyl 2-(2-methoxyethylamino)acetate
SMILESCCOC(=O)CNCCOC
InChIInChI=1S/C7H15NO3/c1-3-11-7(9)6-8-4-5-10-2/h8H,3-6H2,1-2H3
InChIKeyCAFRQFYFJDTUNI-UHFFFAOYSA-N
XLogP-0.21
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-methoxyethylamino)acetate?
The IUPAC name of ethyl 2-(2-methoxyethylamino)acetate (CID 15818815) is ethyl 2-(2-methoxyethylamino)acetate.
What is the SMILES notation for ethyl 2-(2-methoxyethylamino)acetate?
The canonical SMILES for ethyl 2-(2-methoxyethylamino)acetate is CCOC(=O)CNCCOC.
What is the InChIKey of ethyl 2-(2-methoxyethylamino)acetate?
The InChIKey is CAFRQFYFJDTUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-3-11-7(9)6-8-4-5-10-2/h8H,3-6H2,1-2H3.
What are the key properties of ethyl 2-(2-methoxyethylamino)acetate?
ethyl 2-(2-methoxyethylamino)acetate has a molecular weight of 161.20 g/mol, XLogP of -0.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-methoxyethylamino)acetate is sourced from PubChem (CID 15818815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).