(2E)-2-ethylidene-1,3-oxazolidine

C5H9NO — CID 23189281

IUPAC(2E)-2-ethylidene-1,3-oxazolidine
SMILESC/C=C1\NCCO1
InChIInChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3/b5-2+
InChIKeyAJERQJJQMFZGGV-GORDUTHDSA-N
MW99.13 g/mol
LogP0.47
Rot. Bonds

About (2E)-2-ethylidene-1,3-oxazolidine

(2E)-2-ethylidene-1,3-oxazolidine (PubChem CID 23189281) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is (2E)-2-ethylidene-1,3-oxazolidine.

Molecular Properties

Compound Name(2E)-2-ethylidene-1,3-oxazolidine
PubChem CID23189281
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name(2E)-2-ethylidene-1,3-oxazolidine
SMILESC/C=C1\NCCO1
InChIInChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3/b5-2+
InChIKeyAJERQJJQMFZGGV-GORDUTHDSA-N
XLogP0.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2E)-2-ethylidene-1,3-oxazolidine 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 (2E)-2-ethylidene-1,3-oxazolidine?
The IUPAC name of (2E)-2-ethylidene-1,3-oxazolidine (CID 23189281) is (2E)-2-ethylidene-1,3-oxazolidine.
What is the SMILES notation for (2E)-2-ethylidene-1,3-oxazolidine?
The canonical SMILES for (2E)-2-ethylidene-1,3-oxazolidine is C/C=C1\NCCO1.
What is the InChIKey of (2E)-2-ethylidene-1,3-oxazolidine?
The InChIKey is AJERQJJQMFZGGV-GORDUTHDSA-N. The full InChI is InChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3/b5-2+.
What are the key properties of (2E)-2-ethylidene-1,3-oxazolidine?
(2E)-2-ethylidene-1,3-oxazolidine has a molecular weight of 99.13 g/mol, XLogP of 0.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-ethylidene-1,3-oxazolidine is sourced from PubChem (CID 23189281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).