methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate

C8H14N2O5 — CID 55210929

IUPACmethyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCOC(=O)CN(CC(N)=O)CC(=O)OC
InChIInChI=1S/C8H14N2O5/c1-14-7(12)4-10(3-6(9)11)5-8(13)15-2/h3-5H2,1-2H3,(H2,9,11)
InChIKeyBUZJDEDDXIPFQR-UHFFFAOYSA-N
MW218.21 g/mol
LogP-1.88
Rot. Bonds6

About methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate

methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate (PubChem CID 55210929) has the molecular formula C8H14N2O5 and a molecular weight of 218.21 g/mol. Its IUPAC name is methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate
PubChem CID55210929
Molecular FormulaC8H14N2O5
Molecular Weight218.21 g/mol
Exact Mass218.09
IUPAC Namemethyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCOC(=O)CN(CC(N)=O)CC(=O)OC
InChIInChI=1S/C8H14N2O5/c1-14-7(12)4-10(3-6(9)11)5-8(13)15-2/h3-5H2,1-2H3,(H2,9,11)
InChIKeyBUZJDEDDXIPFQR-UHFFFAOYSA-N
XLogP-1.88
TPSA98.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 5-1.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The IUPAC name of methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate (CID 55210929) is methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate.
What is the SMILES notation for methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The canonical SMILES for methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate is COC(=O)CN(CC(N)=O)CC(=O)OC.
What is the InChIKey of methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate?
The InChIKey is BUZJDEDDXIPFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O5/c1-14-7(12)4-10(3-6(9)11)5-8(13)15-2/h3-5H2,1-2H3,(H2,9,11).
What are the key properties of methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate?
methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate has a molecular weight of 218.21 g/mol, XLogP of -1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-amino-2-oxoethyl)-(2-methoxy-2-oxoethyl)amino]acetate is sourced from PubChem (CID 55210929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).