ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate

C11H22N2O4 — CID 55226927

IUPACethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate
SMILESCCOCCN(CC)C(=O)NCC(=O)OCC
InChIInChI=1S/C11H22N2O4/c1-4-13(7-8-16-5-2)11(15)12-9-10(14)17-6-3/h4-9H2,1-3H3,(H,12,15)
InChIKeyOAHMUIJSSVZQOH-UHFFFAOYSA-N
MW246.31 g/mol
LogP0.62
Rot. Bonds8

About ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate

ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate (PubChem CID 55226927) has the molecular formula C11H22N2O4 and a molecular weight of 246.31 g/mol. Its IUPAC name is ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate
PubChem CID55226927
Molecular FormulaC11H22N2O4
Molecular Weight246.31 g/mol
Exact Mass246.16
IUPAC Nameethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate
SMILESCCOCCN(CC)C(=O)NCC(=O)OCC
InChIInChI=1S/C11H22N2O4/c1-4-13(7-8-16-5-2)11(15)12-9-10(14)17-6-3/h4-9H2,1-3H3,(H,12,15)
InChIKeyOAHMUIJSSVZQOH-UHFFFAOYSA-N
XLogP0.62
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(diethylcarbamoylamino)acetate
CID 43385178
ethyl 2-[[[2-(diethylamino)-2-oxoethyl]-methylcarbamoyl]amino]acetate
CID 60968980
N-(2-ethoxyethyl)-N-ethyl-2-(methylamino)acetamide
CID 63691454
N-(2-ethoxyethyl)-N-ethyl-2-methyl-2-(methylamino)propanamide
CID 63690570
1,1,3,3-tetrakis(2-ethoxyethyl)urea
CID 54341985
(2-ethoxy-2-oxoethyl)carbamic acid
CID 18800943
ethyl 2-[[methyl(propan-2-yl)carbamoyl]amino]acetate
CID 43445755
4-[[2-ethoxyethyl(ethyl)carbamoyl]amino]-4-methylpentanoic acid
CID 63690077
cyclopropylmethyl 2-(diethylcarbamoylamino)acetate
CID 71876608
ethyl 3-[2-ethoxyethyl-(3-ethoxy-3-oxopropyl)amino]propanoate
CID 151749760
4-amino-N-(2-ethoxyethyl)-N-ethyloxane-4-carboxamide
CID 113280789
ethyl 2-[[methyl(2-methylbutan-2-yl)carbamoyl]amino]acetate
CID 63960119

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate?
The IUPAC name of ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate (CID 55226927) is ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate?
The canonical SMILES for ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate is CCOCCN(CC)C(=O)NCC(=O)OCC.
What is the InChIKey of ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate?
The InChIKey is OAHMUIJSSVZQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4/c1-4-13(7-8-16-5-2)11(15)12-9-10(14)17-6-3/h4-9H2,1-3H3,(H,12,15).
What are the key properties of ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate?
ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate has a molecular weight of 246.31 g/mol, XLogP of 0.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[2-ethoxyethyl(ethyl)carbamoyl]amino]acetate is sourced from PubChem (CID 55226927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).