methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate

C6H12N2O3 — CID 103101669

IUPACmethyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
SMILESCCN(CC(N)=O)C(=O)OC
InChIInChI=1S/C6H12N2O3/c1-3-8(4-5(7)9)6(10)11-2/h3-4H2,1-2H3,(H2,7,9)
InChIKeyIPYGLCFQRYZIHG-UHFFFAOYSA-N
MW160.17 g/mol
LogP-0.44
Rot. Bonds3

About methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate

methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate (PubChem CID 103101669) has the molecular formula C6H12N2O3 and a molecular weight of 160.17 g/mol. Its IUPAC name is methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate.

Molecular Properties

Compound Namemethyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
PubChem CID103101669
Molecular FormulaC6H12N2O3
Molecular Weight160.17 g/mol
Exact Mass160.08
IUPAC Namemethyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
SMILESCCN(CC(N)=O)C(=O)OC
InChIInChI=1S/C6H12N2O3/c1-3-8(4-5(7)9)6(10)11-2/h3-4H2,1-2H3,(H2,7,9)
InChIKeyIPYGLCFQRYZIHG-UHFFFAOYSA-N
XLogP-0.44
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
CID 103104222
2-[ethyl-(2-methoxyacetyl)amino]acetamide
CID 103104209
methyl N-(3-chloro-2-oxopropyl)-N-ethylcarbamate
CID 104701100
N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide
CID 103103739
4-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-methoxybutanamide
CID 103156901
2-[bis(2-amino-2-oxoethyl)carbamoyl-ethylamino]acetic acid
CID 62923700
3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-2-methylbutanamide
CID 103102016
methyl N-ethyl-N-[2-(methoxycarbonylamino)ethyl]carbamate
CID 141246578
3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-methylbutanamide
CID 103102003
methyl N-[2-[acetyl(methyl)amino]ethyl]-N-ethylcarbamate
CID 143677882
N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
CID 103104212
6-[(2-amino-2-oxoethyl)-ethylamino]-6-oxohexanoic acid
CID 103101524

Frequently Asked Questions

What is the IUPAC name of methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate?
The IUPAC name of methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate (CID 103101669) is methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate.
What is the SMILES notation for methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate?
The canonical SMILES for methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate is CCN(CC(N)=O)C(=O)OC.
What is the InChIKey of methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate?
The InChIKey is IPYGLCFQRYZIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3/c1-3-8(4-5(7)9)6(10)11-2/h3-4H2,1-2H3,(H2,7,9).
What are the key properties of methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate?
methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate has a molecular weight of 160.17 g/mol, XLogP of -0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate is sourced from PubChem (CID 103101669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).