2-aminoethyl 2-(methylamino)acetate

C5H12N2O2 — CID 174621897

IUPAC2-aminoethyl 2-(methylamino)acetate
SMILESCNCC(=O)OCCN
InChIInChI=1S/C5H12N2O2/c1-7-4-5(8)9-3-2-6/h7H,2-4,6H2,1H3
InChIKeyBEEOHJIIJUYXQP-UHFFFAOYSA-N
MW132.16 g/mol
LogP-1.29
Rot. Bonds4

About 2-aminoethyl 2-(methylamino)acetate

2-aminoethyl 2-(methylamino)acetate (PubChem CID 174621897) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is 2-aminoethyl 2-(methylamino)acetate.

Molecular Properties

Compound Name2-aminoethyl 2-(methylamino)acetate
PubChem CID174621897
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Name2-aminoethyl 2-(methylamino)acetate
SMILESCNCC(=O)OCCN
InChIInChI=1S/C5H12N2O2/c1-7-4-5(8)9-3-2-6/h7H,2-4,6H2,1H3
InChIKeyBEEOHJIIJUYXQP-UHFFFAOYSA-N
XLogP-1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyethoxy)ethyl 2-(methylamino)acetate
CID 104563542
butyl 2-(methylamino)acetate;methane
CID 157477406
3-O-(2-aminoethyl) 1-O-methyl propanedioate
CID 57313021
sodium;hydride;pentyl 2-(methylamino)acetate
CID 173079767
CID 156540534
CID 156540534
2-aminoethyl 2-(ethylsulfanylamino)acetate;dihydrochloride
CID 23187581
bis(2-aminoethyl) butanedioate
CID 12073124
2-aminoethyl propanoate;zinc
CID 175266115
1,2-dimethoxyethane;methyl 2-(methylamino)acetate
CID 161160255
azane;methyl 2-(methylamino)acetate
CID 87200278
[2-(methylamino)acetyl]oxysulfanyl 2-aminoacetate
CID 90850764
3-(2-oxobutoxy)propyl 2-(methylamino)acetate
CID 59946828

Frequently Asked Questions

What is the IUPAC name of 2-aminoethyl 2-(methylamino)acetate?
The IUPAC name of 2-aminoethyl 2-(methylamino)acetate (CID 174621897) is 2-aminoethyl 2-(methylamino)acetate.
What is the SMILES notation for 2-aminoethyl 2-(methylamino)acetate?
The canonical SMILES for 2-aminoethyl 2-(methylamino)acetate is CNCC(=O)OCCN.
What is the InChIKey of 2-aminoethyl 2-(methylamino)acetate?
The InChIKey is BEEOHJIIJUYXQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2/c1-7-4-5(8)9-3-2-6/h7H,2-4,6H2,1H3.
What are the key properties of 2-aminoethyl 2-(methylamino)acetate?
2-aminoethyl 2-(methylamino)acetate has a molecular weight of 132.16 g/mol, XLogP of -1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethyl 2-(methylamino)acetate is sourced from PubChem (CID 174621897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).