1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine

C11H19N — CID 135270713

IUPAC1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine
SMILESCCC1C=CC(C)C(/C=N/C)C1
InChIInChI=1S/C11H19N/c1-4-10-6-5-9(2)11(7-10)8-12-3/h5-6,8-11H,4,7H2,1-3H3/b12-8+
InChIKeyVBKIPOOGQLTTEB-XYOKQWHBSA-N
MW165.28 g/mol
LogP2.93
Rot. Bonds2

About 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine

1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine (PubChem CID 135270713) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine.

Molecular Properties

Compound Name1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine
PubChem CID135270713
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine
SMILESCCC1C=CC(C)C(/C=N/C)C1
InChIInChI=1S/C11H19N/c1-4-10-6-5-9(2)11(7-10)8-12-3/h5-6,8-11H,4,7H2,1-3H3/b12-8+
InChIKeyVBKIPOOGQLTTEB-XYOKQWHBSA-N
XLogP2.93
TPSA12.36 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 ≤ 52.93
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'}

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Related Compounds

6-ethyl-3,4-dimethylcyclohexene
CID 123723236
(1R,4R)-4-ethylcyclopent-2-en-1-ol
CID 12026726
4-ethylbicyclo[4.1.0]hept-2-ene
CID 23283002
6-ethyl-3-methyl-4-(2-methylprop-2-enoxy)cyclohexene
CID 176618613
N-(5-ethyl-2-methylcyclohex-3-en-1-yl)-2-methylpropanamide
CID 166041962
2-(4-ethylcyclopent-2-en-1-yl)acetonitrile
CID 59796289
bis((3S,5R)-3-tert-butyl-5-ethylcyclopentene);carbanide;iron(2+)
CID 158203588
4,5-diethyl-3,6-dimethylcyclohexene
CID 59982962
tert-butyl N-(4-ethylcyclopent-2-en-1-yl)-N-hydroxycarbamate
CID 85373698
3-ethyl-1,5-dimethylcyclohexene
CID 123667989
4-ethyl-6-methylcyclohex-2-en-1-imine
CID 123694075
1-ethyl-2-methylcyclopropane;2-methylpropane
CID 155747981

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine?
The IUPAC name of 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine (CID 135270713) is 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine.
What is the SMILES notation for 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine?
The canonical SMILES for 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine is CCC1C=CC(C)C(/C=N/C)C1.
What is the InChIKey of 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine?
The InChIKey is VBKIPOOGQLTTEB-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H19N/c1-4-10-6-5-9(2)11(7-10)8-12-3/h5-6,8-11H,4,7H2,1-3H3/b12-8+.
What are the key properties of 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine?
1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine has a molecular weight of 165.28 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2-methylcyclohex-3-en-1-yl)-N-methylmethanimine is sourced from PubChem (CID 135270713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).