2-[(2-ethoxy-2-oxoethyl)amino]acetic acid

C6H11NO4 — CID 14094492

IUPAC2-[(2-ethoxy-2-oxoethyl)amino]acetic acid
SMILESCCOC(=O)CNCC(=O)O
InChIInChI=1S/C6H11NO4/c1-2-11-6(10)4-7-3-5(8)9/h7H,2-4H2,1H3,(H,8,9)
InChIKeyVVKZCUGDWOHEBO-UHFFFAOYSA-N
MW161.16 g/mol
LogP-0.78
Rot. Bonds5

About 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid

2-[(2-ethoxy-2-oxoethyl)amino]acetic acid (PubChem CID 14094492) has the molecular formula C6H11NO4 and a molecular weight of 161.16 g/mol. Its IUPAC name is 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2-ethoxy-2-oxoethyl)amino]acetic acid
PubChem CID14094492
Molecular FormulaC6H11NO4
Molecular Weight161.16 g/mol
Exact Mass161.07
IUPAC Name2-[(2-ethoxy-2-oxoethyl)amino]acetic acid
SMILESCCOC(=O)CNCC(=O)O
InChIInChI=1S/C6H11NO4/c1-2-11-6(10)4-7-3-5(8)9/h7H,2-4H2,1H3,(H,8,9)
InChIKeyVVKZCUGDWOHEBO-UHFFFAOYSA-N
XLogP-0.78
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid?
The IUPAC name of 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid (CID 14094492) is 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid.
What is the SMILES notation for 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid?
The canonical SMILES for 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid is CCOC(=O)CNCC(=O)O.
What is the InChIKey of 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid?
The InChIKey is VVKZCUGDWOHEBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO4/c1-2-11-6(10)4-7-3-5(8)9/h7H,2-4H2,1H3,(H,8,9).
What are the key properties of 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid?
2-[(2-ethoxy-2-oxoethyl)amino]acetic acid has a molecular weight of 161.16 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethoxy-2-oxoethyl)amino]acetic acid is sourced from PubChem (CID 14094492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).