(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine

C11H17N — CID 89017735

IUPAC(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine
SMILESC=C1CNCC/C1=C/C=C(C)C
InChIInChI=1S/C11H17N/c1-9(2)4-5-11-6-7-12-8-10(11)3/h4-5,12H,3,6-8H2,1-2H3/b11-5-
InChIKeyOEHHQELBSSRGME-WZUFQYTHSA-N
MW163.26 g/mol
LogP2.43
Rot. Bonds1

About (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine

(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine (PubChem CID 89017735) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine.

Molecular Properties

Compound Name(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine
PubChem CID89017735
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine
SMILESC=C1CNCC/C1=C/C=C(C)C
InChIInChI=1S/C11H17N/c1-9(2)4-5-11-6-7-12-8-10(11)3/h4-5,12H,3,6-8H2,1-2H3/b11-5-
InChIKeyOEHHQELBSSRGME-WZUFQYTHSA-N
XLogP2.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine?
The IUPAC name of (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine (CID 89017735) is (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine.
What is the SMILES notation for (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine?
The canonical SMILES for (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine is C=C1CNCC/C1=C/C=C(C)C.
What is the InChIKey of (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine?
The InChIKey is OEHHQELBSSRGME-WZUFQYTHSA-N. The full InChI is InChI=1S/C11H17N/c1-9(2)4-5-11-6-7-12-8-10(11)3/h4-5,12H,3,6-8H2,1-2H3/b11-5-.
What are the key properties of (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine?
(4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine has a molecular weight of 163.26 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-(3-methylbut-2-enylidene)-3-methylidenepiperidine is sourced from PubChem (CID 89017735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).