2-(ethylaminomethoxy)acetic acid

C5H11NO3 — CID 59628102

IUPAC2-(ethylaminomethoxy)acetic acid
SMILESCCNCOCC(=O)O
InChIInChI=1S/C5H11NO3/c1-2-6-4-9-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
InChIKeyVTKYVTZOKZPJJX-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.35
Rot. Bonds5

About 2-(ethylaminomethoxy)acetic acid

2-(ethylaminomethoxy)acetic acid (PubChem CID 59628102) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 2-(ethylaminomethoxy)acetic acid.

Molecular Properties

Compound Name2-(ethylaminomethoxy)acetic acid
PubChem CID59628102
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name2-(ethylaminomethoxy)acetic acid
SMILESCCNCOCC(=O)O
InChIInChI=1S/C5H11NO3/c1-2-6-4-9-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
InChIKeyVTKYVTZOKZPJJX-UHFFFAOYSA-N
XLogP-0.35
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

2-[[2-[2-[2-(hexylamino)ethylamino]ethylamino]ethylamino]methoxy]acetic acid
CID 178182226
2-ethoxyacetic acid
CID 159744705
2-[2-[3-(ethylamino)propylamino]-2-oxoethoxy]acetic acid
CID 61403571
carbonic acid;2-ethoxyacetic acid
CID 174869478
2-[2-[[3-(ethylamino)-2-methylpropanoyl]amino]ethoxy]acetic acid
CID 79457211
2-(carboxymethoxy)acetic acid;sulfane
CID 158807579
2-(carboxymethoxy)acetic acid;hydrochloride
CID 174705448
dichloromethane;2-ethoxyacetic acid
CID 87359195
calcium;N-ethylethanamine;hydride;propanoic acid
CID 174663325
2-[[[2-[[2-[(2-acetamidoacetyl)amino]acetyl]amino]acetyl]amino]methoxy]acetic acid
CID 175851403
2-(2-ethoxy-2-oxoethoxy)acetic acid
CID 11305696
N-(heptoxymethyl)ethanamine
CID 123451436

Frequently Asked Questions

What is the IUPAC name of 2-(ethylaminomethoxy)acetic acid?
The IUPAC name of 2-(ethylaminomethoxy)acetic acid (CID 59628102) is 2-(ethylaminomethoxy)acetic acid.
What is the SMILES notation for 2-(ethylaminomethoxy)acetic acid?
The canonical SMILES for 2-(ethylaminomethoxy)acetic acid is CCNCOCC(=O)O.
What is the InChIKey of 2-(ethylaminomethoxy)acetic acid?
The InChIKey is VTKYVTZOKZPJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3/c1-2-6-4-9-3-5(7)8/h6H,2-4H2,1H3,(H,7,8).
What are the key properties of 2-(ethylaminomethoxy)acetic acid?
2-(ethylaminomethoxy)acetic acid has a molecular weight of 133.15 g/mol, XLogP of -0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylaminomethoxy)acetic acid is sourced from PubChem (CID 59628102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).