ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate

C10H19NO3 — CID 64541597

IUPACethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate
SMILESCCOC(=O)CC1(N(C)C)CCOC1
InChIInChI=1S/C10H19NO3/c1-4-14-9(12)7-10(11(2)3)5-6-13-8-10/h4-8H2,1-3H3
InChIKeyLTOXHGCPGPOKFX-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.66
Rot. Bonds4

About ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate

ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate (PubChem CID 64541597) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate
PubChem CID64541597
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nameethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate
SMILESCCOC(=O)CC1(N(C)C)CCOC1
InChIInChI=1S/C10H19NO3/c1-4-14-9(12)7-10(11(2)3)5-6-13-8-10/h4-8H2,1-3H3
InChIKeyLTOXHGCPGPOKFX-UHFFFAOYSA-N
XLogP0.66
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate?
The IUPAC name of ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate (CID 64541597) is ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate.
What is the SMILES notation for ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate?
The canonical SMILES for ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate is CCOC(=O)CC1(N(C)C)CCOC1.
What is the InChIKey of ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate?
The InChIKey is LTOXHGCPGPOKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-14-9(12)7-10(11(2)3)5-6-13-8-10/h4-8H2,1-3H3.
What are the key properties of ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate?
ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate has a molecular weight of 201.27 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[3-(dimethylamino)oxolan-3-yl]acetate is sourced from PubChem (CID 64541597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).