Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate

Name: Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₀H₁₉NO₃ — CID 45094611

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate

SMILESCCOC(=O)[C@@H]1COC(CC)(CC)N1

InChIInChI=1S/C10H19NO3/c1-4-10(5-2)11-8(7-14-10)9(12)13-6-3/h8,11H,4-7H2,1-3H3/t8-/m0/s1

InChIKeyFPUHZSCXFABJRG-QMMMGPOBSA-N

MW201.27 g/mol

LogP1.05

Rot. Bonds4

About Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate

Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate (PubChem CID 45094611) has the molecular formula C₁₀H₁₉NO₃ and a molecular weight of 201.27 g/mol. Its IUPAC name is ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate.

Molecular Properties

Compound Name	Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate
PubChem CID	45094611
Molecular Formula	C₁₀H₁₉NO₃
Molecular Weight	201.27 g/mol
Exact Mass	201.14
IUPAC Name	ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate
SMILES	CCOC(=O)[C@@H]1COC(CC)(CC)N1
InChI	InChI=1S/C10H19NO3/c1-4-10(5-2)11-8(7-14-10)9(12)13-6-3/h8,11H,4-7H2,1-3H3/t8-/m0/s1
InChIKey	FPUHZSCXFABJRG-QMMMGPOBSA-N
XLogP	1.05
TPSA	47.56 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	14
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	201.27
LogP ≤ 5	1.05
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate?

The IUPAC name of Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate (CID 45094611) is ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate.

What is the SMILES notation for Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate?

The canonical SMILES for Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate is CCOC(=O)[C@@H]1COC(CC)(CC)N1.

What is the InChIKey of Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate?

The InChIKey is FPUHZSCXFABJRG-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-10(5-2)11-8(7-14-10)9(12)13-6-3/h8,11H,4-7H2,1-3H3/t8-/m0/s1.

What are the key properties of Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate?

Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate has a molecular weight of 201.27 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for Ethyl (4S)-2,2-diethyl-1,3-oxazolidine-4-carboxylate is sourced from PubChem (CID 45094611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 45094611 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.