copper(1+);N-cyclohexyl-1-phenylmethanimine

C13H16CuN — CID 135046006

IUPACcopper(1+);N-cyclohexyl-1-phenylmethanimine
SMILES[Cu+].[c-]1ccccc1/C=N/C1CCCCC1
InChIInChI=1S/C13H16N.Cu/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;/h1,3-4,7,11,13H,2,5-6,9-10H2;/q-1;+1/b14-11+;
InChIKeyHPACVIJLUQQFOK-JHGYPSGKSA-N
MW249.82 g/mol
LogP3.24
Rot. Bonds2

About copper(1+);N-cyclohexyl-1-phenylmethanimine

copper(1+);N-cyclohexyl-1-phenylmethanimine (PubChem CID 135046006) has the molecular formula C13H16CuN and a molecular weight of 249.82 g/mol. Its IUPAC name is copper(1+);N-cyclohexyl-1-phenylmethanimine.

Molecular Properties

Compound Namecopper(1+);N-cyclohexyl-1-phenylmethanimine
PubChem CID135046006
Molecular FormulaC13H16CuN
Molecular Weight249.82 g/mol
Exact Mass249.06
IUPAC Namecopper(1+);N-cyclohexyl-1-phenylmethanimine
SMILES[Cu+].[c-]1ccccc1/C=N/C1CCCCC1
InChIInChI=1S/C13H16N.Cu/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;/h1,3-4,7,11,13H,2,5-6,9-10H2;/q-1;+1/b14-11+;
InChIKeyHPACVIJLUQQFOK-JHGYPSGKSA-N
XLogP3.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.82
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze copper(1+);N-cyclohexyl-1-phenylmethanimine 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

(E)-N-cyclohexyl-2-ethylbut-2-en-1-imine
CID 127262357
N-cyclohexyl-1-cyclopenta-1,3-dien-1-ylmethanimine
CID 18293350
(E)-N-cyclohexyl-2-ethylhept-2-en-1-imine
CID 23394363
4-methylidene-N-[4-(methylideneamino)cyclohexyl]cyclohexa-2,5-dien-1-imine
CID 59371115
N-cyclohexyl-2-ethylhept-2-en-1-imine
CID 74047303
5-[(4-methylcyclohexa-1,3-dien-1-yl)methylidene]-3,4-dihydro-2H-pyridine
CID 123572762
lithium N-cyclohexyl-1-phenylmethanimine
CID 9990184
chloroplatinum(1+);N-cyclohexyl-1-[3-(cyclohexyliminomethyl)benzene-2-id-1-yl]methanimine
CID 11455281
(E)-1-(Cyclohex-1-en-1-yl)-N-cyclohexylmethanimine
CID 14472916
N-cyclohexyl-1-(cyclopenten-1-yl)methanimine
CID 14472917
chloroplatinum(1+);N-cyclohexyl-1-[3-(cyclohexyliminomethyl)benzene-2-id-1-yl]methanimine
CID 54693396
(1E)-N-Cyclohexyl-2-ethylbut-2-en-1-imine
CID 71389613

Frequently Asked Questions

What is the IUPAC name of copper(1+);N-cyclohexyl-1-phenylmethanimine?
The IUPAC name of copper(1+);N-cyclohexyl-1-phenylmethanimine (CID 135046006) is copper(1+);N-cyclohexyl-1-phenylmethanimine.
What is the SMILES notation for copper(1+);N-cyclohexyl-1-phenylmethanimine?
The canonical SMILES for copper(1+);N-cyclohexyl-1-phenylmethanimine is [Cu+].[c-]1ccccc1/C=N/C1CCCCC1.
What is the InChIKey of copper(1+);N-cyclohexyl-1-phenylmethanimine?
The InChIKey is HPACVIJLUQQFOK-JHGYPSGKSA-N. The full InChI is InChI=1S/C13H16N.Cu/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;/h1,3-4,7,11,13H,2,5-6,9-10H2;/q-1;+1/b14-11+;.
What are the key properties of copper(1+);N-cyclohexyl-1-phenylmethanimine?
copper(1+);N-cyclohexyl-1-phenylmethanimine has a molecular weight of 249.82 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);N-cyclohexyl-1-phenylmethanimine is sourced from PubChem (CID 135046006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).