1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine

C11H19N — CID 130239325

IUPAC1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine
SMILESC/N=C(\C)C1C(C)C=CCC1C
InChIInChI=1S/C11H19N/c1-8-6-5-7-9(2)11(8)10(3)12-4/h5-6,8-9,11H,7H2,1-4H3/b12-10+
InChIKeyVLCFEKPYEVDMLJ-ZRDIBKRKSA-N
MW165.28 g/mol
LogP2.93
Rot. Bonds1

About 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine

1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine (PubChem CID 130239325) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine.

Molecular Properties

Compound Name1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine
PubChem CID130239325
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine
SMILESC/N=C(\C)C1C(C)C=CCC1C
InChIInChI=1S/C11H19N/c1-8-6-5-7-9(2)11(8)10(3)12-4/h5-6,8-9,11H,7H2,1-4H3/b12-10+
InChIKeyVLCFEKPYEVDMLJ-ZRDIBKRKSA-N
XLogP2.93
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine 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

6-fluoro-N,4-dimethylcyclohex-2-en-1-imine
CID 123297893
(Z)-N-ethyl-7-methyl-6-(trifluoromethyl)oct-2-en-4-imine
CID 166470434
(5S)-N-ethyl-7-fluoro-5,6-dimethylcyclohept-2-en-1-imine
CID 173683200
[2,2-dimethyl-3-[(E)-prop-1-enyl]cyclobutylidene]-dimethylazanium
CID 134861920
[2,2-dimethyl-3-[(Z)-prop-1-enyl]cyclobutylidene]-dimethylazanium
CID 139254724
(Z)-6-ethyl-7-(fluoromethyl)-N-methylundec-8-en-5-imine
CID 143491208
N-methyl-3,4-di(propan-2-yl)cyclohex-2-en-1-imine
CID 20631046
4-Ethyl-2,6-dimethyl-3,4-dihydropyridine
CID 56618361
2,6-Dimethyl-4-propyl-3,4-dihydropyridine
CID 57200011
2,3,5-tri(propan-2-yl)-3H-pyrrole
CID 58164588
N,6-di(propan-2-yl)cyclohexa-2,4-dien-1-imine
CID 58916542
(2S)-2-methyl-6-(2-methylpropyl)-2,3-dihydropyridine
CID 67991639

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine?
The IUPAC name of 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine (CID 130239325) is 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine.
What is the SMILES notation for 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine?
The canonical SMILES for 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine is C/N=C(\C)C1C(C)C=CCC1C.
What is the InChIKey of 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine?
The InChIKey is VLCFEKPYEVDMLJ-ZRDIBKRKSA-N. The full InChI is InChI=1S/C11H19N/c1-8-6-5-7-9(2)11(8)10(3)12-4/h5-6,8-9,11H,7H2,1-4H3/b12-10+.
What are the key properties of 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine?
1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine has a molecular weight of 165.28 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylcyclohex-3-en-1-yl)-N-methylethanimine is sourced from PubChem (CID 130239325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).