2-[carboxymethyl(2-methoxyethyl)amino]acetic acid

C7H13NO5 — CID 23422586

IUPAC2-[carboxymethyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)CC(=O)O
InChIInChI=1S/C7H13NO5/c1-13-3-2-8(4-6(9)10)5-7(11)12/h2-5H2,1H3,(H,9,10)(H,11,12)
InChIKeyGGJBWKXZCQRJAV-UHFFFAOYSA-N
MW191.18 g/mol
LogP-0.90
Rot. Bonds7

About 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid

2-[carboxymethyl(2-methoxyethyl)amino]acetic acid (PubChem CID 23422586) has the molecular formula C7H13NO5 and a molecular weight of 191.18 g/mol. Its IUPAC name is 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[carboxymethyl(2-methoxyethyl)amino]acetic acid
PubChem CID23422586
Molecular FormulaC7H13NO5
Molecular Weight191.18 g/mol
Exact Mass191.08
IUPAC Name2-[carboxymethyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)CC(=O)O
InChIInChI=1S/C7H13NO5/c1-13-3-2-8(4-6(9)10)5-7(11)12/h2-5H2,1H3,(H,9,10)(H,11,12)
InChIKeyGGJBWKXZCQRJAV-UHFFFAOYSA-N
XLogP-0.90
TPSA87.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.18
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Nitrilotriacetic Acid
CID 8758
Bicine
CID 8761
(2-Hydroxyethyl)iminodiacetic acid
CID 7152
Glycine, N,N-dimethyl-, methyl ester
CID 81569
4-Morpholineacetic acid
CID 438968
Glycine, N,N-dimethyl-, ethyl ester
CID 118412
N-methyliminodiacetic acid
CID 20441
Glycine, N,N-bis(2-hydroxyethyl)-, sodium salt (1:1)
CID 23690434
Disodium hydroxyethyliminodiacetate
CID 8670
Glycine, N,N-diethyl-, ethyl ester
CID 75843
N,N-Diethylglycine
CID 74151
Bis(2-aminoethyl) ether N,N,N',N'-tetraacetic acid
CID 13540

Frequently Asked Questions

What is the IUPAC name of 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid (CID 23422586) is 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)CC(=O)O.
What is the InChIKey of 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid?
The InChIKey is GGJBWKXZCQRJAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO5/c1-13-3-2-8(4-6(9)10)5-7(11)12/h2-5H2,1H3,(H,9,10)(H,11,12).
What are the key properties of 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid?
2-[carboxymethyl(2-methoxyethyl)amino]acetic acid has a molecular weight of 191.18 g/mol, XLogP of -0.90, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[carboxymethyl(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 23422586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).