N-cyclohexyl-N'-cyclohexylmethanediimine

C13H21N2+ — CID 59513364

IUPACN-cyclohexyl-N'-cyclohexylmethanediimine
SMILESC(=NC1CC[CH+]CC1)=NC1CCCCC1
InChIInChI=1S/C13H21N2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1,12-13H,2-10H2/q+1
InChIKeyFFRXLZVIESLXSE-UHFFFAOYSA-N
MW205.32 g/mol
LogP3.64
Rot. Bonds2

About N-cyclohexyl-N'-cyclohexylmethanediimine

N-cyclohexyl-N'-cyclohexylmethanediimine (PubChem CID 59513364) has the molecular formula C13H21N2+ and a molecular weight of 205.32 g/mol. Its IUPAC name is N-cyclohexyl-N'-cyclohexylmethanediimine.

Molecular Properties

Compound NameN-cyclohexyl-N'-cyclohexylmethanediimine
PubChem CID59513364
Molecular FormulaC13H21N2+
Molecular Weight205.32 g/mol
Exact Mass205.17
IUPAC NameN-cyclohexyl-N'-cyclohexylmethanediimine
SMILESC(=NC1CC[CH+]CC1)=NC1CCCCC1
InChIInChI=1S/C13H21N2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1,12-13H,2-10H2/q+1
InChIKeyFFRXLZVIESLXSE-UHFFFAOYSA-N
XLogP3.64
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N'-cyclohexylmethanediimine?
The IUPAC name of N-cyclohexyl-N'-cyclohexylmethanediimine (CID 59513364) is N-cyclohexyl-N'-cyclohexylmethanediimine.
What is the SMILES notation for N-cyclohexyl-N'-cyclohexylmethanediimine?
The canonical SMILES for N-cyclohexyl-N'-cyclohexylmethanediimine is C(=NC1CC[CH+]CC1)=NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-N'-cyclohexylmethanediimine?
The InChIKey is FFRXLZVIESLXSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1,12-13H,2-10H2/q+1.
What are the key properties of N-cyclohexyl-N'-cyclohexylmethanediimine?
N-cyclohexyl-N'-cyclohexylmethanediimine has a molecular weight of 205.32 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-cyclohexylmethanediimine is sourced from PubChem (CID 59513364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).