(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate

C9H13NO4 — CID 11252619

IUPAC(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate
SMILESC=CC(=O)OCC1(CC)COC(=O)N1
InChIInChI=1S/C9H13NO4/c1-3-7(11)13-5-9(4-2)6-14-8(12)10-9/h3H,1,4-6H2,2H3,(H,10,12)
InChIKeyGNMCBCWJPIVMQR-UHFFFAOYSA-N
MW199.21 g/mol
LogP0.60
Rot. Bonds4

About (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate

(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate (PubChem CID 11252619) has the molecular formula C9H13NO4 and a molecular weight of 199.21 g/mol. Its IUPAC name is (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate.

Molecular Properties

Compound Name(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate
PubChem CID11252619
Molecular FormulaC9H13NO4
Molecular Weight199.21 g/mol
Exact Mass199.08
IUPAC Name(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate
SMILESC=CC(=O)OCC1(CC)COC(=O)N1
InChIInChI=1S/C9H13NO4/c1-3-7(11)13-5-9(4-2)6-14-8(12)10-9/h3H,1,4-6H2,2H3,(H,10,12)
InChIKeyGNMCBCWJPIVMQR-UHFFFAOYSA-N
XLogP0.60
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl (Z)-but-2-enoate
CID 15859264
(4-ethyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)methyl prop-2-enoate
CID 71325039
(4-ethenyl-2-oxo-1,3-dioxolan-4-yl)methyl prop-2-enoate
CID 70213115
[3-(prop-2-enoyloxymethyl)oxetan-3-yl]methyl prop-2-enoate
CID 172769604
4-ethyl-4-hydroxy-1,3-oxazolidin-2-one
CID 19933761
(5-ethyl-2-phenyl-1,3,2-dioxaborinan-5-yl)methyl prop-2-enoate
CID 153107264
2-(3-ethyl-3-methyloxetan-2-ylidene)ethyl prop-2-enoate
CID 174998381
(1-ethyl-2,2-dimethyl-4,5-dioxocyclopentyl)methyl prop-2-enoate
CID 59609109
(3-butyloxetan-3-yl)methyl prop-2-enoate
CID 23067252
(2-phosphonooxyoxiran-2-yl)methyl prop-2-enoate
CID 156783562
3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione;ethyl prop-2-enoate
CID 67103551
[9-[12-[6,12-dioxo-3,3-bis(prop-2-enoyloxymethyl)-1,5-dioxa-9-azacyclododec-9-yl]dodecyl]-6,12-dioxo-3-(prop-2-enoyloxymethyl)-1,5-dioxa-9-azacyclododec-3-yl]methyl prop-2-enoate
CID 16748659

Frequently Asked Questions

What is the IUPAC name of (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate?
The IUPAC name of (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate (CID 11252619) is (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate.
What is the SMILES notation for (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate?
The canonical SMILES for (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate is C=CC(=O)OCC1(CC)COC(=O)N1.
What is the InChIKey of (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate?
The InChIKey is GNMCBCWJPIVMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO4/c1-3-7(11)13-5-9(4-2)6-14-8(12)10-9/h3H,1,4-6H2,2H3,(H,10,12).
What are the key properties of (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate?
(4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate has a molecular weight of 199.21 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-2-oxo-1,3-oxazolidin-4-yl)methyl prop-2-enoate is sourced from PubChem (CID 11252619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).