2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate

C8H11NO4 — CID 22728782

IUPAC2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate
SMILESC=CC(=O)OCCN1CCOC1=O
InChIInChI=1S/C8H11NO4/c1-2-7(10)12-5-3-9-4-6-13-8(9)11/h2H,1,3-6H2
InChIKeyPZRBEFHNJXWNAM-UHFFFAOYSA-N
MW185.18 g/mol
LogP0.17
Rot. Bonds4

About 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate

2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate (PubChem CID 22728782) has the molecular formula C8H11NO4 and a molecular weight of 185.18 g/mol. Its IUPAC name is 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate.

Molecular Properties

Compound Name2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate
PubChem CID22728782
Molecular FormulaC8H11NO4
Molecular Weight185.18 g/mol
Exact Mass185.07
IUPAC Name2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate
SMILESC=CC(=O)OCCN1CCOC1=O
InChIInChI=1S/C8H11NO4/c1-2-7(10)12-5-3-9-4-6-13-8(9)11/h2H,1,3-6H2
InChIKeyPZRBEFHNJXWNAM-UHFFFAOYSA-N
XLogP0.17
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]benzoic acid
CID 43532506
4-(2-oxo-1,3-oxazolidin-3-yl)butanehydrazide
CID 61405937
2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl prop-2-enoate
CID 58283249
3-prop-2-enyl-1,3-oxazolidin-2-one;silane
CID 175362572
3-[2-(4-aminophenoxy)ethyl]-1,3-oxazolidin-2-one
CID 43365795
3-(2-bromoethyl)-1,3-oxazolidin-2-one
CID 22757234
2-(4-prop-2-enoylpiperazin-1-yl)ethyl prop-2-enoate
CID 18934215
3-octadecyl-1,3-oxazolidin-2-one
CID 59720965
2-hydroxy-4-(2-oxo-1,3-oxazolidin-3-yl)butanoic acid
CID 107836616
2-(2-oxo-1,3-oxazolidin-3-yl)ethyl 2-oxo-1H-quinoline-4-carboxylate
CID 36510492
2-prop-2-enoyloxyethyl prop-2-enoate;zinc
CID 88622091
3-(aminomethyl)-1,3-oxazolidin-2-one;hydrochloride
CID 141105157

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate?
The IUPAC name of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate (CID 22728782) is 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate.
What is the SMILES notation for 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate?
The canonical SMILES for 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate is C=CC(=O)OCCN1CCOC1=O.
What is the InChIKey of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate?
The InChIKey is PZRBEFHNJXWNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO4/c1-2-7(10)12-5-3-9-4-6-13-8(9)11/h2H,1,3-6H2.
What are the key properties of 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate?
2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate has a molecular weight of 185.18 g/mol, XLogP of 0.17, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1,3-oxazolidin-3-yl)ethyl prop-2-enoate is sourced from PubChem (CID 22728782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).