methyl 2-(ethylamino)acetate

C5H11NO2 — CID 12591596

IUPACmethyl 2-(ethylamino)acetate
SMILESCCNCC(=O)OC
InChIInChI=1S/C5H11NO2/c1-3-6-4-5(7)8-2/h6H,3-4H2,1-2H3
InChIKeyNYEHYTMDKFXJEE-UHFFFAOYSA-N
MW117.15 g/mol
LogP-0.23
Rot. Bonds3

About methyl 2-(ethylamino)acetate

methyl 2-(ethylamino)acetate (PubChem CID 12591596) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is methyl 2-(ethylamino)acetate.

Molecular Properties

Compound Namemethyl 2-(ethylamino)acetate
PubChem CID12591596
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Namemethyl 2-(ethylamino)acetate
SMILESCCNCC(=O)OC
InChIInChI=1S/C5H11NO2/c1-3-6-4-5(7)8-2/h6H,3-4H2,1-2H3
InChIKeyNYEHYTMDKFXJEE-UHFFFAOYSA-N
XLogP-0.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 2-(ethylamino)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-Ethylglycine
CID 316542
Ethyl acetamidoacetate
CID 74702
Ethyl N-methylaminoacetate hydrochloride
CID 171173
Methyl 2-acetamidoacetate
CID 517966
Diethyl iminodiacetate
CID 80502
Sarcosine methyl ester
CID 83545
Glycine, N-methyl-, ethyl ester
CID 95849
Ethyl 2-(ethylamino)acetate
CID 12591597
Glycine, N-methyl-, methyl ester, hydrochloride (1:1)
CID 83544
(Ethylammonio)acetate
CID 6992079
Dimethyl Iminodiacetate Hydrochloride
CID 2727727
Methyl 2-[(2-methoxy-2-oxoethyl)amino]acetate
CID 428827

Frequently Asked Questions

What is the IUPAC name of methyl 2-(ethylamino)acetate?
The IUPAC name of methyl 2-(ethylamino)acetate (CID 12591596) is methyl 2-(ethylamino)acetate.
What is the SMILES notation for methyl 2-(ethylamino)acetate?
The canonical SMILES for methyl 2-(ethylamino)acetate is CCNCC(=O)OC.
What is the InChIKey of methyl 2-(ethylamino)acetate?
The InChIKey is NYEHYTMDKFXJEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c1-3-6-4-5(7)8-2/h6H,3-4H2,1-2H3.
What are the key properties of methyl 2-(ethylamino)acetate?
methyl 2-(ethylamino)acetate has a molecular weight of 117.15 g/mol, XLogP of -0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(ethylamino)acetate is sourced from PubChem (CID 12591596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).