(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine

C11H15N — CID 176520993

IUPAC(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine
SMILESC=C=C1CCCN/C1=C/C=C\C
InChIInChI=1S/C11H15N/c1-3-5-8-11-10(4-2)7-6-9-12-11/h3,5,8,12H,2,6-7,9H2,1H3/b5-3-,11-8+
InChIKeyQLKNCVAVUJHDAY-NJHUYJSNSA-N
MW161.25 g/mol
LogP2.54
Rot. Bonds1

About (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine

(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine (PubChem CID 176520993) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine.

Molecular Properties

Compound Name(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine
PubChem CID176520993
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine
SMILESC=C=C1CCCN/C1=C/C=C\C
InChIInChI=1S/C11H15N/c1-3-5-8-11-10(4-2)7-6-9-12-11/h3,5,8,12H,2,6-7,9H2,1H3/b5-3-,11-8+
InChIKeyQLKNCVAVUJHDAY-NJHUYJSNSA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine?
The IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine (CID 176520993) is (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine.
What is the SMILES notation for (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine?
The canonical SMILES for (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine is C=C=C1CCCN/C1=C/C=C\C.
What is the InChIKey of (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine?
The InChIKey is QLKNCVAVUJHDAY-NJHUYJSNSA-N. The full InChI is InChI=1S/C11H15N/c1-3-5-8-11-10(4-2)7-6-9-12-11/h3,5,8,12H,2,6-7,9H2,1H3/b5-3-,11-8+.
What are the key properties of (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine?
(2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine has a molecular weight of 161.25 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-but-2-enylidene]-3-ethenylidenepiperidine is sourced from PubChem (CID 176520993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).