phenyl-(1-piperidin-1-ylcyclohexyl)methanimine

C18H26N2 — CID 15048602

IUPACphenyl-(1-piperidin-1-ylcyclohexyl)methanimine
SMILES[H]/N=C(\c1ccccc1)C1(N2CCCCC2)CCCCC1
InChIInChI=1S/C18H26N2/c19-17(16-10-4-1-5-11-16)18(12-6-2-7-13-18)20-14-8-3-9-15-20/h1,4-5,10-11,19H,2-3,6-9,12-15H2/b19-17+
InChIKeyYLLKWGGUFIEFMP-HTXNQAPBSA-N
MW270.42 g/mol
LogP4.24
Rot. Bonds3

About phenyl-(1-piperidin-1-ylcyclohexyl)methanimine

phenyl-(1-piperidin-1-ylcyclohexyl)methanimine (PubChem CID 15048602) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is phenyl-(1-piperidin-1-ylcyclohexyl)methanimine.

Molecular Properties

Compound Namephenyl-(1-piperidin-1-ylcyclohexyl)methanimine
PubChem CID15048602
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Namephenyl-(1-piperidin-1-ylcyclohexyl)methanimine
SMILES[H]/N=C(\c1ccccc1)C1(N2CCCCC2)CCCCC1
InChIInChI=1S/C18H26N2/c19-17(16-10-4-1-5-11-16)18(12-6-2-7-13-18)20-14-8-3-9-15-20/h1,4-5,10-11,19H,2-3,6-9,12-15H2/b19-17+
InChIKeyYLLKWGGUFIEFMP-HTXNQAPBSA-N
XLogP4.24
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 phenyl-(1-piperidin-1-ylcyclohexyl)methanimine?
The IUPAC name of phenyl-(1-piperidin-1-ylcyclohexyl)methanimine (CID 15048602) is phenyl-(1-piperidin-1-ylcyclohexyl)methanimine.
What is the SMILES notation for phenyl-(1-piperidin-1-ylcyclohexyl)methanimine?
The canonical SMILES for phenyl-(1-piperidin-1-ylcyclohexyl)methanimine is [H]/N=C(\c1ccccc1)C1(N2CCCCC2)CCCCC1.
What is the InChIKey of phenyl-(1-piperidin-1-ylcyclohexyl)methanimine?
The InChIKey is YLLKWGGUFIEFMP-HTXNQAPBSA-N. The full InChI is InChI=1S/C18H26N2/c19-17(16-10-4-1-5-11-16)18(12-6-2-7-13-18)20-14-8-3-9-15-20/h1,4-5,10-11,19H,2-3,6-9,12-15H2/b19-17+.
What are the key properties of phenyl-(1-piperidin-1-ylcyclohexyl)methanimine?
phenyl-(1-piperidin-1-ylcyclohexyl)methanimine has a molecular weight of 270.42 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(1-piperidin-1-ylcyclohexyl)methanimine is sourced from PubChem (CID 15048602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).