(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane

C10H15NO — CID 143809182

IUPAC(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane
SMILESC/C=C\C=C1\OCNC\C1=C\C
InChIInChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h3-6,11H,7-8H2,1-2H3/b5-3-,9-4-,10-6+
InChIKeyJKMSDRCJFLNTEZ-WRNHEFAQSA-N
MW165.24 g/mol
LogP1.97
Rot. Bonds1

About (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane

(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane (PubChem CID 143809182) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane.

Molecular Properties

Compound Name(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane
PubChem CID143809182
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane
SMILESC/C=C\C=C1\OCNC\C1=C\C
InChIInChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h3-6,11H,7-8H2,1-2H3/b5-3-,9-4-,10-6+
InChIKeyJKMSDRCJFLNTEZ-WRNHEFAQSA-N
XLogP1.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane?
The IUPAC name of (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane (CID 143809182) is (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane.
What is the SMILES notation for (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane?
The canonical SMILES for (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane is C/C=C\C=C1\OCNC\C1=C\C.
What is the InChIKey of (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane?
The InChIKey is JKMSDRCJFLNTEZ-WRNHEFAQSA-N. The full InChI is InChI=1S/C10H15NO/c1-3-5-6-10-9(4-2)7-11-8-12-10/h3-6,11H,7-8H2,1-2H3/b5-3-,9-4-,10-6+.
What are the key properties of (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane?
(5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane has a molecular weight of 165.24 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6E)-6-[(Z)-but-2-enylidene]-5-ethylidene-1,3-oxazinane is sourced from PubChem (CID 143809182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).