ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate

C11H21NO3 — CID 82837469

IUPACethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate
SMILESCCNC(CC(=O)OCC)C1CCCO1
InChIInChI=1S/C11H21NO3/c1-3-12-9(8-11(13)14-4-2)10-6-5-7-15-10/h9-10,12H,3-8H2,1-2H3
InChIKeyWWWLDAQOFIGXLQ-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.10
Rot. Bonds6

About ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate

ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate (PubChem CID 82837469) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate.

Molecular Properties

Compound Nameethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate
PubChem CID82837469
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Nameethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate
SMILESCCNC(CC(=O)OCC)C1CCCO1
InChIInChI=1S/C11H21NO3/c1-3-12-9(8-11(13)14-4-2)10-6-5-7-15-10/h9-10,12H,3-8H2,1-2H3
InChIKeyWWWLDAQOFIGXLQ-UHFFFAOYSA-N
XLogP1.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate 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 3-hydroxy-3-(oxolan-2-yl)propanoate
CID 82837463
2-(ethylamino)-2-(oxolan-2-yl)ethanol
CID 82838374
N-ethyl-3-methyl-1-(oxan-2-yl)but-3-en-1-amine
CID 105004067
N-ethyl-1-(oxolan-2-yl)but-3-yn-1-amine
CID 65328587
ethyl 3-oxo-2-(oxolan-2-yl)butanoate
CID 14416095
ethyl 2-oxo-2-[1-(oxolan-2-yl)ethylamino]acetate
CID 60895927
dimethyl 2-(oxolan-2-yl)butanedioate
CID 3877780
ethyl 2-[hydroxy(oxolan-2-yl)methyl]butanoate
CID 82837689
N-[1-(oxolan-2-yl)propyl]acetamide
CID 130615261
ethyl 3-oxo-3-[(2S)-oxolan-2-yl]propanoate
CID 40787289
ethyl (2R)-2-acetyloxy-2-[(2R)-oxolan-2-yl]acetate
CID 11241385
ethyl 3-(oxan-3-yl)-3-(propylamino)propanoate
CID 65236041

Frequently Asked Questions

What is the IUPAC name of ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate?
The IUPAC name of ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate (CID 82837469) is ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate.
What is the SMILES notation for ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate?
The canonical SMILES for ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate is CCNC(CC(=O)OCC)C1CCCO1.
What is the InChIKey of ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate?
The InChIKey is WWWLDAQOFIGXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-3-12-9(8-11(13)14-4-2)10-6-5-7-15-10/h9-10,12H,3-8H2,1-2H3.
What are the key properties of ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate?
ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate has a molecular weight of 215.29 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-(ethylamino)-3-(oxolan-2-yl)propanoate is sourced from PubChem (CID 82837469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).