ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate

C11H21NO4 — CID 102607480

IUPACethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate
SMILESCCNC(C)(COC1COC1)C(=O)OCC
InChIInChI=1S/C11H21NO4/c1-4-12-11(3,10(13)15-5-2)8-16-9-6-14-7-9/h9,12H,4-8H2,1-3H3
InChIKeyZEHITEQPZWTBLF-UHFFFAOYSA-N
MW231.29 g/mol
LogP0.33
Rot. Bonds7

About ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate

ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate (PubChem CID 102607480) has the molecular formula C11H21NO4 and a molecular weight of 231.29 g/mol. Its IUPAC name is ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate.

Molecular Properties

Compound Nameethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate
PubChem CID102607480
Molecular FormulaC11H21NO4
Molecular Weight231.29 g/mol
Exact Mass231.15
IUPAC Nameethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate
SMILESCCNC(C)(COC1COC1)C(=O)OCC
InChIInChI=1S/C11H21NO4/c1-4-12-11(3,10(13)15-5-2)8-16-9-6-14-7-9/h9,12H,4-8H2,1-3H3
InChIKeyZEHITEQPZWTBLF-UHFFFAOYSA-N
XLogP0.33
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)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

methyl 2-(ethylamino)-2-methyl-4-(oxetan-3-yloxy)butanoate
CID 102607468
ethyl 2-methyl-5-(oxetan-3-yloxy)-2-(propylamino)pentanoate
CID 102607567
ethyl 4-[cyclopropyl(3-methylbutyl)amino]-2-(ethylamino)-2-methylbutanoate
CID 78977417
ethyl 2-(ethylamino)-2-methyl-4-[methyl(oxan-4-yl)amino]pentanoate
CID 64710194
ethyl 2-methyl-2-(oxetan-3-yl)propanoate
CID 170912678
2-hydroxy-2-methyl-3-(oxetan-3-yloxy)propanoic acid
CID 102605319
ethyl 2-methyl-2-(methylamino)-4-(oxetan-3-ylsulfanyl)pentanoate
CID 79326786
ethyl 2-(ethylamino)-2-methyl-4-[2-methylpropyl(propan-2-yl)amino]pentanoate
CID 64710888
ethyl 3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(ethylamino)-2-methylpropanoate
CID 115561599
ethyl 2-cyclopropyl-2-(ethylamino)propanoate
CID 60788384
ethyl 3-(3-ethoxyphenoxy)-2-(ethylamino)-2-methylpropanoate
CID 62337488
ethyl 6-(3,4-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-methylhexanoate
CID 79177873

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate?
The IUPAC name of ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate (CID 102607480) is ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate.
What is the SMILES notation for ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate?
The canonical SMILES for ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate is CCNC(C)(COC1COC1)C(=O)OCC.
What is the InChIKey of ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate?
The InChIKey is ZEHITEQPZWTBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO4/c1-4-12-11(3,10(13)15-5-2)8-16-9-6-14-7-9/h9,12H,4-8H2,1-3H3.
What are the key properties of ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate?
ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate has a molecular weight of 231.29 g/mol, XLogP of 0.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(ethylamino)-2-methyl-3-(oxetan-3-yloxy)propanoate is sourced from PubChem (CID 102607480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).