1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine

C10H17N — CID 166650373

IUPAC1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine
SMILESC/N=C/C1=C(C)CCC(C)C1
InChIInChI=1S/C10H17N/c1-8-4-5-9(2)10(6-8)7-11-3/h7-8H,4-6H2,1-3H3/b11-7+
InChIKeyLTJPIKMVJNEYPG-YRNVUSSQSA-N
MW151.25 g/mol
LogP2.82
Rot. Bonds1

About 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine

1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine (PubChem CID 166650373) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine.

Molecular Properties

Compound Name1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine
PubChem CID166650373
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine
SMILESC/N=C/C1=C(C)CCC(C)C1
InChIInChI=1S/C10H17N/c1-8-4-5-9(2)10(6-8)7-11-3/h7-8H,4-6H2,1-3H3/b11-7+
InChIKeyLTJPIKMVJNEYPG-YRNVUSSQSA-N
XLogP2.82
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine?
The IUPAC name of 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine (CID 166650373) is 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine.
What is the SMILES notation for 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine?
The canonical SMILES for 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine is C/N=C/C1=C(C)CCC(C)C1.
What is the InChIKey of 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine?
The InChIKey is LTJPIKMVJNEYPG-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H17N/c1-8-4-5-9(2)10(6-8)7-11-3/h7-8H,4-6H2,1-3H3/b11-7+.
What are the key properties of 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine?
1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine has a molecular weight of 151.25 g/mol, XLogP of 2.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylcyclohexen-1-yl)-N-methylmethanimine is sourced from PubChem (CID 166650373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).