2-ethylidene-1,3-oxazolidine

C5H9NO — CID 68559195

IUPAC2-ethylidene-1,3-oxazolidine
SMILESCC=C1NCCO1
InChIInChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3
InChIKeyAJERQJJQMFZGGV-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.47
Rot. Bonds

About 2-ethylidene-1,3-oxazolidine

2-ethylidene-1,3-oxazolidine (PubChem CID 68559195) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 2-ethylidene-1,3-oxazolidine.

Molecular Properties

Compound Name2-ethylidene-1,3-oxazolidine
PubChem CID68559195
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name2-ethylidene-1,3-oxazolidine
SMILESCC=C1NCCO1
InChIInChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3
InChIKeyAJERQJJQMFZGGV-UHFFFAOYSA-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

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Frequently Asked Questions

What is the IUPAC name of 2-ethylidene-1,3-oxazolidine?
The IUPAC name of 2-ethylidene-1,3-oxazolidine (CID 68559195) is 2-ethylidene-1,3-oxazolidine.
What is the SMILES notation for 2-ethylidene-1,3-oxazolidine?
The canonical SMILES for 2-ethylidene-1,3-oxazolidine is CC=C1NCCO1.
What is the InChIKey of 2-ethylidene-1,3-oxazolidine?
The InChIKey is AJERQJJQMFZGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2,6H,3-4H2,1H3.
What are the key properties of 2-ethylidene-1,3-oxazolidine?
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 2-ethylidene-1,3-oxazolidine is sourced from PubChem (CID 68559195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).