2-[ethyl(methoxy)amino]acetic acid

C5H11NO3 — CID 87131030

IUPAC2-[ethyl(methoxy)amino]acetic acid
SMILESCCN(CC(=O)O)OC
InChIInChI=1S/C5H11NO3/c1-3-6(9-2)4-5(7)8/h3-4H2,1-2H3,(H,7,8)
InChIKeyZTYUEVNAZFKRJC-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.05
Rot. Bonds4

About 2-[ethyl(methoxy)amino]acetic acid

2-[ethyl(methoxy)amino]acetic acid (PubChem CID 87131030) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 2-[ethyl(methoxy)amino]acetic acid.

Molecular Properties

Compound Name2-[ethyl(methoxy)amino]acetic acid
PubChem CID87131030
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name2-[ethyl(methoxy)amino]acetic acid
SMILESCCN(CC(=O)O)OC
InChIInChI=1S/C5H11NO3/c1-3-6(9-2)4-5(7)8/h3-4H2,1-2H3,(H,7,8)
InChIKeyZTYUEVNAZFKRJC-UHFFFAOYSA-N
XLogP-0.05
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(dimethoxyamino)acetic acid
CID 156905250
2-[carboxymethyl(propanoyl)amino]acetic acid
CID 18934284
2-[carbamoyl(methoxy)amino]acetic acid
CID 55288680
ethyl(methoxy)carbamic acid
CID 20532492
2-[ethyl(sulfanyl)amino]acetic acid
CID 22364290
potassium;2-[2-aminoethyl(ethoxy)amino]acetic acid;hydride
CID 174575586
2-[ethyl-[2-(methoxycarbonylamino)-2-oxoethyl]amino]acetic acid
CID 61011883
ethane;2-[ethyl(propyl)amino]acetic acid
CID 143677754
2-[ethyl(sulfino)amino]acetic acid
CID 175553270
3-[ethyl(methoxy)amino]propan-1-ol
CID 87086707
2-[tert-butyl(4-methoxybutan-2-yl)amino]acetic acid
CID 79268714
buta-1,3-diene;2-(diethylamino)acetic acid
CID 87268914

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methoxy)amino]acetic acid?
The IUPAC name of 2-[ethyl(methoxy)amino]acetic acid (CID 87131030) is 2-[ethyl(methoxy)amino]acetic acid.
What is the SMILES notation for 2-[ethyl(methoxy)amino]acetic acid?
The canonical SMILES for 2-[ethyl(methoxy)amino]acetic acid is CCN(CC(=O)O)OC.
What is the InChIKey of 2-[ethyl(methoxy)amino]acetic acid?
The InChIKey is ZTYUEVNAZFKRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3/c1-3-6(9-2)4-5(7)8/h3-4H2,1-2H3,(H,7,8).
What are the key properties of 2-[ethyl(methoxy)amino]acetic acid?
2-[ethyl(methoxy)amino]acetic acid has a molecular weight of 133.15 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methoxy)amino]acetic acid is sourced from PubChem (CID 87131030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).