sodium 2-(2-hydroxyethylamino)acetate

C4H8NNaO3 — CID 23668304

IUPACsodium 2-(2-hydroxyethylamino)acetate
SMILESO=C([O-])CNCCO.[Na+]
InChIInChI=1S/C4H9NO3.Na/c6-2-1-5-3-4(7)8;/h5-6H,1-3H2,(H,7,8);/q;+1/p-1
InChIKeyUILYXOTXWSYIHA-UHFFFAOYSA-M
MW141.10 g/mol
LogP-5.68
Rot. Bonds4

About sodium 2-(2-hydroxyethylamino)acetate

sodium 2-(2-hydroxyethylamino)acetate (PubChem CID 23668304) has the molecular formula C4H8NNaO3 and a molecular weight of 141.10 g/mol. Its IUPAC name is sodium 2-(2-hydroxyethylamino)acetate.

Molecular Properties

Compound Namesodium 2-(2-hydroxyethylamino)acetate
PubChem CID23668304
Molecular FormulaC4H8NNaO3
Molecular Weight141.10 g/mol
Exact Mass141.04
IUPAC Namesodium 2-(2-hydroxyethylamino)acetate
SMILESO=C([O-])CNCCO.[Na+]
InChIInChI=1S/C4H9NO3.Na/c6-2-1-5-3-4(7)8;/h5-6H,1-3H2,(H,7,8);/q;+1/p-1
InChIKeyUILYXOTXWSYIHA-UHFFFAOYSA-M
XLogP-5.68
TPSA72.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.10
LogP ≤ 5-5.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

tetrasodium bis(2-(carboxylatomethylamino)acetate)
CID 141397482
disodium bis(2-(2-aminoethylamino)acetate)
CID 173036397
sodium 2-(2-hydroxyethylamino)acetic acid
CID 22056559
sodium;2-(2-aminoethylamino)acetate;tris(ethane-1,2-diamine)
CID 23701740
disodium;2-[2-[carboxylatomethyl(2-hydroxyethyl)amino]ethylamino]acetate
CID 6454342
diazanium;2-(carboxylatomethylamino)acetate
CID 18769481
tetrasodium;tetrakis(2-(carboxymethylamino)acetate)
CID 141289708
2-(2-hydroxyethylamino)acetic acid;phosphane
CID 174633538
trisodium;2-(2-aminoethylamino)ethanol;triacetate;hydrate
CID 172795947
sodium 4-(hydroxymethylamino)butanoate
CID 141391824
carbonic acid;bis(2-(2-hydroxyethylamino)ethanol)
CID 163568127
sodium;2-[2-[bis(carboxylatomethyl)amino]ethylamino]acetate;titanium(4+);peroxide;hydrate
CID 139141755

Frequently Asked Questions

What is the IUPAC name of sodium 2-(2-hydroxyethylamino)acetate?
The IUPAC name of sodium 2-(2-hydroxyethylamino)acetate (CID 23668304) is sodium 2-(2-hydroxyethylamino)acetate.
What is the SMILES notation for sodium 2-(2-hydroxyethylamino)acetate?
The canonical SMILES for sodium 2-(2-hydroxyethylamino)acetate is O=C([O-])CNCCO.[Na+].
What is the InChIKey of sodium 2-(2-hydroxyethylamino)acetate?
The InChIKey is UILYXOTXWSYIHA-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9NO3.Na/c6-2-1-5-3-4(7)8;/h5-6H,1-3H2,(H,7,8);/q;+1/p-1.
What are the key properties of sodium 2-(2-hydroxyethylamino)acetate?
sodium 2-(2-hydroxyethylamino)acetate has a molecular weight of 141.10 g/mol, XLogP of -5.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 2-(2-hydroxyethylamino)acetate is sourced from PubChem (CID 23668304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).