ethyl 2-aminoacetate

C4H9NO2 — CID 12176

IUPACethyl 2-aminoacetate
SMILESCCOC(=O)CN
InChIInChI=1S/C4H9NO2/c1-2-7-4(6)3-5/h2-3,5H2,1H3
InChIKeyNTNZTEQNFHNYBC-UHFFFAOYSA-N
MW103.12 g/mol
LogP-0.49
Rot. Bonds2

About ethyl 2-aminoacetate

ethyl 2-aminoacetate (PubChem CID 12176) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is ethyl 2-aminoacetate.

Molecular Properties

Compound Nameethyl 2-aminoacetate
PubChem CID12176
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC Nameethyl 2-aminoacetate
SMILESCCOC(=O)CN
InChIInChI=1S/C4H9NO2/c1-2-7-4(6)3-5/h2-3,5H2,1H3
InChIKeyNTNZTEQNFHNYBC-UHFFFAOYSA-N
XLogP-0.49
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Glycine ethyl ester, hydrochloride
CID 2723640
Glycine methyl ester hydrochloride
CID 122755
Glycine methyl ester
CID 69221
Ethyl aminoacetate hydrochloride
CID 12175
Glycine, N-methyl-, ethyl ester
CID 95849
2-aminoethyl Acetate
CID 112720
Propyl aminoacetate hydrochloride
CID 2759254
Glycine, butyl ester, hydrochloride (1:1)
CID 83080
NoName_3047
CID 69236
L-Alanine ethyl ester
CID 76507
Glycine, 1,1'-anhydride
CID 20177
2-Aminoethyl acetate hydrochloride
CID 19930857

Frequently Asked Questions

What is the IUPAC name of ethyl 2-aminoacetate?
The IUPAC name of ethyl 2-aminoacetate (CID 12176) is ethyl 2-aminoacetate.
What is the SMILES notation for ethyl 2-aminoacetate?
The canonical SMILES for ethyl 2-aminoacetate is CCOC(=O)CN.
What is the InChIKey of ethyl 2-aminoacetate?
The InChIKey is NTNZTEQNFHNYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c1-2-7-4(6)3-5/h2-3,5H2,1H3.
What are the key properties of ethyl 2-aminoacetate?
ethyl 2-aminoacetate has a molecular weight of 103.12 g/mol, XLogP of -0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-aminoacetate is sourced from PubChem (CID 12176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).