ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate

C9H18N2O4 — CID 79282629

IUPACethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate
SMILESCCOC(=O)CNC(=O)CNCCOC
InChIInChI=1S/C9H18N2O4/c1-3-15-9(13)7-11-8(12)6-10-4-5-14-2/h10H,3-7H2,1-2H3,(H,11,12)
InChIKeyWWFPDUUQIWRHKO-UHFFFAOYSA-N
MW218.25 g/mol
LogP-1.10
Rot. Bonds8

About ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate

ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate (PubChem CID 79282629) has the molecular formula C9H18N2O4 and a molecular weight of 218.25 g/mol. Its IUPAC name is ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate
PubChem CID79282629
Molecular FormulaC9H18N2O4
Molecular Weight218.25 g/mol
Exact Mass218.13
IUPAC Nameethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate
SMILESCCOC(=O)CNC(=O)CNCCOC
InChIInChI=1S/C9H18N2O4/c1-3-15-9(13)7-11-8(12)6-10-4-5-14-2/h10H,3-7H2,1-2H3,(H,11,12)
InChIKeyWWFPDUUQIWRHKO-UHFFFAOYSA-N
XLogP-1.10
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 5-1.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-(2-methoxyethylamino)acetamide
CID 28565523
2-(2-methoxyethylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646688
ethyl 4-[2-(2-methoxyethylamino)acetyl]piperazine-1-carboxylate
CID 71628424
2-methoxyethyl 2-(2-methoxyethylamino)acetate
CID 79271319
methyl 3-[[2-(2-methoxyethylamino)acetyl]amino]-2,2-dimethylpropanoate
CID 119789402
ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]propanoate
CID 79282260
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
N-(2-methoxyethyl)-2-(2-propoxyethylamino)acetamide
CID 106452448
ethyl 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetate
CID 7020070
2-(butylamino)-N-(2-methoxyethyl)acetamide
CID 54815346
N-hydroxy-2-(2-methoxyethylamino)acetamide
CID 79282707
2-(2-ethoxyethylamino)-N-(3-methoxypropyl)acetamide
CID 61486039

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate?
The IUPAC name of ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate (CID 79282629) is ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate?
The canonical SMILES for ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate is CCOC(=O)CNC(=O)CNCCOC.
What is the InChIKey of ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate?
The InChIKey is WWFPDUUQIWRHKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O4/c1-3-15-9(13)7-11-8(12)6-10-4-5-14-2/h10H,3-7H2,1-2H3,(H,11,12).
What are the key properties of ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate?
ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate has a molecular weight of 218.25 g/mol, XLogP of -1.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate is sourced from PubChem (CID 79282629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).