(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane

C13H23N — CID 153388202

IUPAC(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane
SMILESC/C=C1/CCCC(=C\C)/C1=N\C.CC
InChIInChI=1S/C11H17N.C2H6/c1-4-9-7-6-8-10(5-2)11(9)12-3;1-2/h4-5H,6-8H2,1-3H3;1-2H3/b9-4-,10-5+,12-11-;
InChIKeyMJFBQQPDQWCVSD-XPKCIDAASA-N
MW193.33 g/mol
LogP4.16
Rot. Bonds

About (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane

(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane (PubChem CID 153388202) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane.

Molecular Properties

Compound Name(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane
PubChem CID153388202
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane
SMILESC/C=C1/CCCC(=C\C)/C1=N\C.CC
InChIInChI=1S/C11H17N.C2H6/c1-4-9-7-6-8-10(5-2)11(9)12-3;1-2/h4-5H,6-8H2,1-3H3;1-2H3/b9-4-,10-5+,12-11-;
InChIKeyMJFBQQPDQWCVSD-XPKCIDAASA-N
XLogP4.16
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_one_ene_A(57)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1E,2Z)-1,2-di(ethylidene)cyclohexane
CID 102070913
1,2-di(ethylidene)cyclooctane
CID 134898176
(1E)-1-ethylidene-2-methylidenecyclopentane
CID 142947641
ethane;(1Z,2Z)-1-ethylidene-2-propylidenecyclopentane;fluoromethane
CID 142105046
ethane;(2Z)-N-methyl-2-prop-2-enylidenecyclopentan-1-imine
CID 143214227
(1Z,2Z)-1-[(Z)-but-2-enylidene]-2-ethylidenecyclohexane;ethane
CID 142131776
(1Z,2Z)-1-[(Z)-but-2-enylidene]-2-ethylidenecycloheptane;ethane
CID 143536598
ethane;(1Z,2Z)-1-ethylidene-2-prop-2-enylidenecycloheptane
CID 143924638
(3Z)-3-ethylidene-N-methylpiperidin-4-imine
CID 143890086
(2E)-2-[(2E)-2-(3,3-dimethyl-1H-indol-2-ylidene)ethylidene]-6-[2-(3,3-dimethyl-1H-indol-2-ylidene)ethylidene]-N-methylcyclohexan-1-imine
CID 174001765
1,2-di(ethylidene)cyclopropane
CID 123857340
1-ethylidene-2-prop-2-enylidenecyclooctane
CID 91407681

Frequently Asked Questions

What is the IUPAC name of (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane?
The IUPAC name of (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane (CID 153388202) is (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane.
What is the SMILES notation for (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane?
The canonical SMILES for (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane is C/C=C1/CCCC(=C\C)/C1=N\C.CC.
What is the InChIKey of (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane?
The InChIKey is MJFBQQPDQWCVSD-XPKCIDAASA-N. The full InChI is InChI=1S/C11H17N.C2H6/c1-4-9-7-6-8-10(5-2)11(9)12-3;1-2/h4-5H,6-8H2,1-3H3;1-2H3/b9-4-,10-5+,12-11-;.
What are the key properties of (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane?
(2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane has a molecular weight of 193.33 g/mol, XLogP of 4.16, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6Z)-2,6-di(ethylidene)-N-methylcyclohexan-1-imine;ethane is sourced from PubChem (CID 153388202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).