(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine

C11H19N — CID 23524296

IUPAC(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine
SMILESC=CCC1CCN(C)C/C1=C\C
InChIInChI=1S/C11H19N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-5,11H,1,6-9H2,2-3H3/b10-5+
InChIKeyNNMNYTJJDGYZOK-BJMVGYQFSA-N
MW165.28 g/mol
LogP2.46
Rot. Bonds2

About (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine

(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine (PubChem CID 23524296) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine.

Molecular Properties

Compound Name(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine
PubChem CID23524296
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine
SMILESC=CCC1CCN(C)C/C1=C\C
InChIInChI=1S/C11H19N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-5,11H,1,6-9H2,2-3H3/b10-5+
InChIKeyNNMNYTJJDGYZOK-BJMVGYQFSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Piperidine, 1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6446865
N,N-Diethyl-3,7-dimethyl-6-octen-1-amine
CID 14525584
1-Geranylpiperidine
CID 12760939
3-Cyclohexene-1-methylamine, N,N-diethyl-, hydrochloride
CID 200463
Cambridge id 5410985
CID 28239625
1-(2,5-Dimethyl-1,4-hexadien-1-YL)piperidine
CID 24209787
1-(3,7-Dimethyl-6-octen-1-yl)-4-methylpiperazine
CID 2845214
1-(3,7-Dimethyloct-6-en-1-yl)piperidine
CID 3592771
1-[(E)-2-ethylhex-2-enyl]-1-methylpiperidin-1-ium
CID 6152674
Piperidine, 1-(2,7-octadienyl)-
CID 4248884
4-Ethenyl-1-methylpiperidine
CID 10154055
1-(4-Prop-1-en-2-ylcyclohex-2-en-1-yl)piperidine
CID 12485228

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine?
The IUPAC name of (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine (CID 23524296) is (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine.
What is the SMILES notation for (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine?
The canonical SMILES for (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine is C=CCC1CCN(C)C/C1=C\C.
What is the InChIKey of (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine?
The InChIKey is NNMNYTJJDGYZOK-BJMVGYQFSA-N. The full InChI is InChI=1S/C11H19N/c1-4-6-11-7-8-12(3)9-10(11)5-2/h4-5,11H,1,6-9H2,2-3H3/b10-5+.
What are the key properties of (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine?
(3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine has a molecular weight of 165.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-ethylidene-1-methyl-4-prop-2-enylpiperidine is sourced from PubChem (CID 23524296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).