methyl 2-(2-methoxyethylamino)acetate

C6H13NO3 — CID 28565694

IUPACmethyl 2-(2-methoxyethylamino)acetate
SMILESCOCCNCC(=O)OC
InChIInChI=1S/C6H13NO3/c1-9-4-3-7-5-6(8)10-2/h7H,3-5H2,1-2H3
InChIKeyDOYRRBSQRQWDHJ-UHFFFAOYSA-N
MW147.17 g/mol
LogP-0.60
Rot. Bonds5

About methyl 2-(2-methoxyethylamino)acetate

methyl 2-(2-methoxyethylamino)acetate (PubChem CID 28565694) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is methyl 2-(2-methoxyethylamino)acetate.

Molecular Properties

Compound Namemethyl 2-(2-methoxyethylamino)acetate
PubChem CID28565694
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Namemethyl 2-(2-methoxyethylamino)acetate
SMILESCOCCNCC(=O)OC
InChIInChI=1S/C6H13NO3/c1-9-4-3-7-5-6(8)10-2/h7H,3-5H2,1-2H3
InChIKeyDOYRRBSQRQWDHJ-UHFFFAOYSA-N
XLogP-0.60
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-0.60
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 methyl 2-(2-methoxyethylamino)acetate?
The IUPAC name of methyl 2-(2-methoxyethylamino)acetate (CID 28565694) is methyl 2-(2-methoxyethylamino)acetate.
What is the SMILES notation for methyl 2-(2-methoxyethylamino)acetate?
The canonical SMILES for methyl 2-(2-methoxyethylamino)acetate is COCCNCC(=O)OC.
What is the InChIKey of methyl 2-(2-methoxyethylamino)acetate?
The InChIKey is DOYRRBSQRQWDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-9-4-3-7-5-6(8)10-2/h7H,3-5H2,1-2H3.
What are the key properties of methyl 2-(2-methoxyethylamino)acetate?
methyl 2-(2-methoxyethylamino)acetate has a molecular weight of 147.17 g/mol, XLogP of -0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-methoxyethylamino)acetate is sourced from PubChem (CID 28565694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).