(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane

C11H16O — CID 89289028

IUPAC(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane
SMILESC/C=C\C=C1\CCCO\C1=C/C
InChIInChI=1S/C11H16O/c1-3-5-7-10-8-6-9-12-11(10)4-2/h3-5,7H,6,8-9H2,1-2H3/b5-3-,10-7-,11-4-
InChIKeyHQYYHHNWQUPKOU-IGCUISKOSA-N
MW164.25 g/mol
LogP3.20
Rot. Bonds1

About (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane

(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane (PubChem CID 89289028) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane.

Molecular Properties

Compound Name(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane
PubChem CID89289028
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane
SMILESC/C=C\C=C1\CCCO\C1=C/C
InChIInChI=1S/C11H16O/c1-3-5-7-10-8-6-9-12-11(10)4-2/h3-5,7H,6,8-9H2,1-2H3/b5-3-,10-7-,11-4-
InChIKeyHQYYHHNWQUPKOU-IGCUISKOSA-N
XLogP3.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane 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 (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane?
The IUPAC name of (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane (CID 89289028) is (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane.
What is the SMILES notation for (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane?
The canonical SMILES for (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane is C/C=C\C=C1\CCCO\C1=C/C.
What is the InChIKey of (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane?
The InChIKey is HQYYHHNWQUPKOU-IGCUISKOSA-N. The full InChI is InChI=1S/C11H16O/c1-3-5-7-10-8-6-9-12-11(10)4-2/h3-5,7H,6,8-9H2,1-2H3/b5-3-,10-7-,11-4-.
What are the key properties of (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane?
(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane has a molecular weight of 164.25 g/mol, XLogP of 3.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane is sourced from PubChem (CID 89289028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).