(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine

C11H17N — CID 89473072

IUPAC(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine
SMILESC=C1CCCN(C)/C1=C/C=C\C
InChIInChI=1S/C11H17N/c1-4-5-8-11-10(2)7-6-9-12(11)3/h4-5,8H,2,6-7,9H2,1,3H3/b5-4-,11-8+
InChIKeyABLUHOMINCZYCM-LGXSBLIVSA-N
MW163.26 g/mol
LogP2.73
Rot. Bonds1

About (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine

(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine (PubChem CID 89473072) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine.

Molecular Properties

Compound Name(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine
PubChem CID89473072
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine
SMILESC=C1CCCN(C)/C1=C/C=C\C
InChIInChI=1S/C11H17N/c1-4-5-8-11-10(2)7-6-9-12(11)3/h4-5,8H,2,6-7,9H2,1,3H3/b5-4-,11-8+
InChIKeyABLUHOMINCZYCM-LGXSBLIVSA-N
XLogP2.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine 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 (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine?
The IUPAC name of (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine (CID 89473072) is (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine.
What is the SMILES notation for (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine?
The canonical SMILES for (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine is C=C1CCCN(C)/C1=C/C=C\C.
What is the InChIKey of (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine?
The InChIKey is ABLUHOMINCZYCM-LGXSBLIVSA-N. The full InChI is InChI=1S/C11H17N/c1-4-5-8-11-10(2)7-6-9-12(11)3/h4-5,8H,2,6-7,9H2,1,3H3/b5-4-,11-8+.
What are the key properties of (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine?
(2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine has a molecular weight of 163.26 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-but-2-enylidene]-1-methyl-3-methylidenepiperidine is sourced from PubChem (CID 89473072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).