(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine

C11H17N — CID 89468901

IUPAC(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine
SMILESC=C/C=C1/CCN(C)C/C1=C/C
InChIInChI=1S/C11H17N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-6H,1,7-9H2,2-3H3/b10-5-,11-6-
InChIKeyKWDGBHQGBAAJSU-IEESQIRDSA-N
MW163.26 g/mol
LogP2.38
Rot. Bonds1

About (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine

(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine (PubChem CID 89468901) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine.

Molecular Properties

Compound Name(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine
PubChem CID89468901
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine
SMILESC=C/C=C1/CCN(C)C/C1=C/C
InChIInChI=1S/C11H17N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-6H,1,7-9H2,2-3H3/b10-5-,11-6-
InChIKeyKWDGBHQGBAAJSU-IEESQIRDSA-N
XLogP2.38
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 ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine?
The IUPAC name of (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine (CID 89468901) is (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine.
What is the SMILES notation for (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine?
The canonical SMILES for (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine is C=C/C=C1/CCN(C)C/C1=C/C.
What is the InChIKey of (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine?
The InChIKey is KWDGBHQGBAAJSU-IEESQIRDSA-N. The full InChI is InChI=1S/C11H17N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-6H,1,7-9H2,2-3H3/b10-5-,11-6-.
What are the key properties of (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine?
(3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine has a molecular weight of 163.26 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4Z)-3-ethylidene-1-methyl-4-prop-2-enylidenepiperidine is sourced from PubChem (CID 89468901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).