(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane

C11H20N2 — CID 142162049

IUPAC(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane
SMILESC.C=C/N=C1\CN(C)CC\C1=C\C
InChIInChI=1S/C10H16N2.CH4/c1-4-9-6-7-12(3)8-10(9)11-5-2;/h4-5H,2,6-8H2,1,3H3;1H4/b9-4-,11-10+;
InChIKeyROPSMXIFYKMNNU-AFLSZMNUSA-N
MW180.29 g/mol
LogP2.49
Rot. Bonds1

About (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane

(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane (PubChem CID 142162049) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane.

Molecular Properties

Compound Name(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane
PubChem CID142162049
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane
SMILESC.C=C/N=C1\CN(C)CC\C1=C\C
InChIInChI=1S/C10H16N2.CH4/c1-4-9-6-7-12(3)8-10(9)11-5-2;/h4-5H,2,6-8H2,1,3H3;1H4/b9-4-,11-10+;
InChIKeyROPSMXIFYKMNNU-AFLSZMNUSA-N
XLogP2.49
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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CID 57531003
N-[(1Z)-buta-1,3-dienyl]-2-methyl-3-(1-methylpiperidin-4-ylidene)propan-1-imine
CID 89366339
1-[(3E,4E)-3-(2-cyclohexa-1,5-dien-1-yl-2-ethenyliminoethylidene)hepta-4,6-dien-2-yl]-N,N-diethylpiperidin-4-amine
CID 117611664
(3Z)-N,1-dimethyl-3-prop-2-enylidenepiperidin-4-imine
CID 123418614
5,10-Dimethyl-1,2,3,4,8,9-hexahydropyrido[3,2-b]azocin-5-ium
CID 123870333
(3E)-2-ethyl-3-ethylidene-N-methyl-N-propyl-4H-pyridin-4-amine
CID 132195135
(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine
CID 134386167
2,7-Dimethyl-4,6,8,9-tetrahydropyrido[4,3-b]azepine
CID 134406498
7-Methyl-2,3,4,6,8,9-hexahydropyrido[4,3-b]azepine
CID 141946412
(2E,5E,7E,9Z)-N-ethenyl-6,7-diethyl-3-methyl-2-piperidin-1-yldodeca-2,5,7,9,11-pentaen-4-imine;methane
CID 141961098
1-[(Z)-but-2-en-2-yl]piperidine;(E)-4-cyclohepta-1,6-dien-1-yl-3-ethyl-N-prop-1-en-2-ylhex-3-en-2-imine;ethane;hydrochloride
CID 141961249
N-[(Z)-5-(1-methylpiperidin-4-ylidene)pent-1-enyl]ethanimine
CID 142099607

Frequently Asked Questions

What is the IUPAC name of (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane?
The IUPAC name of (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane (CID 142162049) is (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane.
What is the SMILES notation for (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane?
The canonical SMILES for (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane is C.C=C/N=C1\CN(C)CC\C1=C\C.
What is the InChIKey of (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane?
The InChIKey is ROPSMXIFYKMNNU-AFLSZMNUSA-N. The full InChI is InChI=1S/C10H16N2.CH4/c1-4-9-6-7-12(3)8-10(9)11-5-2;/h4-5H,2,6-8H2,1,3H3;1H4/b9-4-,11-10+;.
What are the key properties of (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane?
(4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane has a molecular weight of 180.29 g/mol, XLogP of 2.49, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-N-ethenyl-4-ethylidene-1-methylpiperidin-3-imine;methane is sourced from PubChem (CID 142162049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).