2-amino-2-(2-ethoxyethoxy)acetic acid

C6H13NO4 — CID 87123000

IUPAC2-amino-2-(2-ethoxyethoxy)acetic acid
SMILESCCOCCOC(N)C(=O)O
InChIInChI=1S/C6H13NO4/c1-2-10-3-4-11-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)
InChIKeyLMGXXCLZRPXYIK-UHFFFAOYSA-N
MW163.17 g/mol
LogP-0.59
Rot. Bonds6

About 2-amino-2-(2-ethoxyethoxy)acetic acid

2-amino-2-(2-ethoxyethoxy)acetic acid (PubChem CID 87123000) has the molecular formula C6H13NO4 and a molecular weight of 163.17 g/mol. Its IUPAC name is 2-amino-2-(2-ethoxyethoxy)acetic acid.

Molecular Properties

Compound Name2-amino-2-(2-ethoxyethoxy)acetic acid
PubChem CID87123000
Molecular FormulaC6H13NO4
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name2-amino-2-(2-ethoxyethoxy)acetic acid
SMILESCCOCCOC(N)C(=O)O
InChIInChI=1S/C6H13NO4/c1-2-10-3-4-11-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)
InChIKeyLMGXXCLZRPXYIK-UHFFFAOYSA-N
XLogP-0.59
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2-ethoxyethoxy)acetic acid?
The IUPAC name of 2-amino-2-(2-ethoxyethoxy)acetic acid (CID 87123000) is 2-amino-2-(2-ethoxyethoxy)acetic acid.
What is the SMILES notation for 2-amino-2-(2-ethoxyethoxy)acetic acid?
The canonical SMILES for 2-amino-2-(2-ethoxyethoxy)acetic acid is CCOCCOC(N)C(=O)O.
What is the InChIKey of 2-amino-2-(2-ethoxyethoxy)acetic acid?
The InChIKey is LMGXXCLZRPXYIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO4/c1-2-10-3-4-11-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9).
What are the key properties of 2-amino-2-(2-ethoxyethoxy)acetic acid?
2-amino-2-(2-ethoxyethoxy)acetic acid has a molecular weight of 163.17 g/mol, XLogP of -0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2-ethoxyethoxy)acetic acid is sourced from PubChem (CID 87123000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).