4-(2-phenylethyliminomethyl)phenol

C15H15NO — CID 2056794

IUPAC4-(2-phenylethyliminomethyl)phenol
SMILESOc1ccc(/C=N/CCc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c17-15-8-6-14(7-9-15)12-16-11-10-13-4-2-1-3-5-13/h1-9,12,17H,10-11H2/b16-12+
InChIKeyQPPNIQMNSLTBNG-FOWTUZBSSA-N
MW225.29 g/mol
LogP3.05
Rot. Bonds4

About 4-(2-phenylethyliminomethyl)phenol

4-(2-phenylethyliminomethyl)phenol (PubChem CID 2056794) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 4-(2-phenylethyliminomethyl)phenol.

Molecular Properties

Compound Name4-(2-phenylethyliminomethyl)phenol
PubChem CID2056794
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name4-(2-phenylethyliminomethyl)phenol
SMILESOc1ccc(/C=N/CCc2ccccc2)cc1
InChIInChI=1S/C15H15NO/c17-15-8-6-14(7-9-15)12-16-11-10-13-4-2-1-3-5-13/h1-9,12,17H,10-11H2/b16-12+
InChIKeyQPPNIQMNSLTBNG-FOWTUZBSSA-N
XLogP3.05
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.05
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 4-(2-phenylethyliminomethyl)phenol?
The IUPAC name of 4-(2-phenylethyliminomethyl)phenol (CID 2056794) is 4-(2-phenylethyliminomethyl)phenol.
What is the SMILES notation for 4-(2-phenylethyliminomethyl)phenol?
The canonical SMILES for 4-(2-phenylethyliminomethyl)phenol is Oc1ccc(/C=N/CCc2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylethyliminomethyl)phenol?
The InChIKey is QPPNIQMNSLTBNG-FOWTUZBSSA-N. The full InChI is InChI=1S/C15H15NO/c17-15-8-6-14(7-9-15)12-16-11-10-13-4-2-1-3-5-13/h1-9,12,17H,10-11H2/b16-12+.
What are the key properties of 4-(2-phenylethyliminomethyl)phenol?
4-(2-phenylethyliminomethyl)phenol has a molecular weight of 225.29 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethyliminomethyl)phenol is sourced from PubChem (CID 2056794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).