sodium 2-(methylamino)acetate

C3H6NNaO2 — CID 23667259

IUPACsodium 2-(methylamino)acetate
SMILESCNCC(=O)[O-].[Na+]
InChIInChI=1S/C3H7NO2.Na/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);/q;+1/p-1
InChIKeyZUFONQSOSYEWCN-UHFFFAOYSA-M
MW111.08 g/mol
LogP-5.04
Rot. Bonds2

About sodium 2-(methylamino)acetate

sodium 2-(methylamino)acetate (PubChem CID 23667259) has the molecular formula C3H6NNaO2 and a molecular weight of 111.08 g/mol. Its IUPAC name is sodium 2-(methylamino)acetate.

Molecular Properties

Compound Namesodium 2-(methylamino)acetate
PubChem CID23667259
Molecular FormulaC3H6NNaO2
Molecular Weight111.08 g/mol
Exact Mass111.03
IUPAC Namesodium 2-(methylamino)acetate
SMILESCNCC(=O)[O-].[Na+]
InChIInChI=1S/C3H7NO2.Na/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);/q;+1/p-1
InChIKeyZUFONQSOSYEWCN-UHFFFAOYSA-M
XLogP-5.04
TPSA52.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.08
LogP ≤ 5-5.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Sarcosine
CID 1088
(Methylazaniumyl)acetate
CID 7311726
(Dimethylammonio)acetate
CID 6971056
Sarcosinate
CID 9543102
Iminodiacetic acid, disodium salt
CID 13575
Glycine, N-methyl-, hydrochloride (1:1)
CID 69483
Iminodiacetate
CID 3344189
((Carboxymethyl)amino)acetate
CID 6995749
Sarcosinium
CID 16755639
(Ethylammonio)acetate
CID 6992079
Sarcosine C-11
CID 73443002
Sarcosine-d3 (methyl-d3)
CID 16213596

Frequently Asked Questions

What is the IUPAC name of sodium 2-(methylamino)acetate?
The IUPAC name of sodium 2-(methylamino)acetate (CID 23667259) is sodium 2-(methylamino)acetate.
What is the SMILES notation for sodium 2-(methylamino)acetate?
The canonical SMILES for sodium 2-(methylamino)acetate is CNCC(=O)[O-].[Na+].
What is the InChIKey of sodium 2-(methylamino)acetate?
The InChIKey is ZUFONQSOSYEWCN-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H7NO2.Na/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);/q;+1/p-1.
What are the key properties of sodium 2-(methylamino)acetate?
sodium 2-(methylamino)acetate has a molecular weight of 111.08 g/mol, XLogP of -5.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 2-(methylamino)acetate is sourced from PubChem (CID 23667259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).