3-ethyl-2-methylidene-1,3-oxazolidine

C6H11NO — CID 89320737

IUPAC3-ethyl-2-methylidene-1,3-oxazolidine
SMILESC=C1OCCN1CC
InChIInChI=1S/C6H11NO/c1-3-7-4-5-8-6(7)2/h2-5H2,1H3
InChIKeyHYTOPECXURUEDC-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.81
Rot. Bonds1

About 3-ethyl-2-methylidene-1,3-oxazolidine

3-ethyl-2-methylidene-1,3-oxazolidine (PubChem CID 89320737) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 3-ethyl-2-methylidene-1,3-oxazolidine.

Molecular Properties

Compound Name3-ethyl-2-methylidene-1,3-oxazolidine
PubChem CID89320737
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name3-ethyl-2-methylidene-1,3-oxazolidine
SMILESC=C1OCCN1CC
InChIInChI=1S/C6H11NO/c1-3-7-4-5-8-6(7)2/h2-5H2,1H3
InChIKeyHYTOPECXURUEDC-UHFFFAOYSA-N
XLogP0.81
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methylidene-1,3-oxazolidine?
The IUPAC name of 3-ethyl-2-methylidene-1,3-oxazolidine (CID 89320737) is 3-ethyl-2-methylidene-1,3-oxazolidine.
What is the SMILES notation for 3-ethyl-2-methylidene-1,3-oxazolidine?
The canonical SMILES for 3-ethyl-2-methylidene-1,3-oxazolidine is C=C1OCCN1CC.
What is the InChIKey of 3-ethyl-2-methylidene-1,3-oxazolidine?
The InChIKey is HYTOPECXURUEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-3-7-4-5-8-6(7)2/h2-5H2,1H3.
What are the key properties of 3-ethyl-2-methylidene-1,3-oxazolidine?
3-ethyl-2-methylidene-1,3-oxazolidine has a molecular weight of 113.16 g/mol, XLogP of 0.81, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methylidene-1,3-oxazolidine is sourced from PubChem (CID 89320737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).