(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine

C₉H₁₃NO — CID 142971051

About (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine

(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine (PubChem CID 142971051) has the molecular formula C₉H₁₃NO and a molecular weight of 151.21 g/mol. Its IUPAC name is (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine.

Molecular Properties

• Compound Name: (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine
• PubChem CID: 142971051
• Molecular Formula: C₉H₁₃NO
• Molecular Weight: 151.21 g/mol
• Exact Mass: 151.10
• IUPAC Name: (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine
• SMILES: C=C/C=C1/OC(C)N/C1=C/C
• InChI: InChI=1S/C9H13NO/c1-4-6-9-8(5-2)10-7(3)11-9/h4-7,10H,1H2,2-3H3/b8-5+,9-6+
• InChIKey: WXKASYHEVFYNCJ-XVYDYJIPSA-N
• XLogP: 1.93
• TPSA: 21.26 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 11
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	151.21
LogP ≤ 5	1.93
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine?

The IUPAC name of (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine (CID 142971051) is (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine.

What is the SMILES notation for (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine?

The canonical SMILES for (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine is C=C/C=C1/OC(C)N/C1=C/C.

What is the InChIKey of (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine?

The InChIKey is WXKASYHEVFYNCJ-XVYDYJIPSA-N. The full InChI is InChI=1S/C9H13NO/c1-4-6-9-8(5-2)10-7(3)11-9/h4-7,10H,1H2,2-3H3/b8-5+,9-6+.

What are the key properties of (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine?

(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine has a molecular weight of 151.21 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine is sourced from PubChem (CID 142971051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 142971051 — identifiers, structure, computed properties (public domain)

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