2-[(E)-3-phenyliminoprop-1-enyl]phenol

C15H13NO — CID 135770174

IUPAC2-[(E)-3-phenyliminoprop-1-enyl]phenol
SMILESOc1ccccc1/C=C/C=N/c1ccccc1
InChIInChI=1S/C15H13NO/c17-15-11-5-4-7-13(15)8-6-12-16-14-9-2-1-3-10-14/h1-12,17H/b8-6+,16-12+
InChIKeyOQBDXLLDNVQYKX-YUDPATCQSA-N
MW223.28 g/mol
LogP3.81
Rot. Bonds3

About 2-[(E)-3-phenyliminoprop-1-enyl]phenol

2-[(E)-3-phenyliminoprop-1-enyl]phenol (PubChem CID 135770174) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[(E)-3-phenyliminoprop-1-enyl]phenol.

Molecular Properties

Compound Name2-[(E)-3-phenyliminoprop-1-enyl]phenol
PubChem CID135770174
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name2-[(E)-3-phenyliminoprop-1-enyl]phenol
SMILESOc1ccccc1/C=C/C=N/c1ccccc1
InChIInChI=1S/C15H13NO/c17-15-11-5-4-7-13(15)8-6-12-16-14-9-2-1-3-10-14/h1-12,17H/b8-6+,16-12+
InChIKeyOQBDXLLDNVQYKX-YUDPATCQSA-N
XLogP3.81
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.81
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 2-[(E)-3-phenyliminoprop-1-enyl]phenol?
The IUPAC name of 2-[(E)-3-phenyliminoprop-1-enyl]phenol (CID 135770174) is 2-[(E)-3-phenyliminoprop-1-enyl]phenol.
What is the SMILES notation for 2-[(E)-3-phenyliminoprop-1-enyl]phenol?
The canonical SMILES for 2-[(E)-3-phenyliminoprop-1-enyl]phenol is Oc1ccccc1/C=C/C=N/c1ccccc1.
What is the InChIKey of 2-[(E)-3-phenyliminoprop-1-enyl]phenol?
The InChIKey is OQBDXLLDNVQYKX-YUDPATCQSA-N. The full InChI is InChI=1S/C15H13NO/c17-15-11-5-4-7-13(15)8-6-12-16-14-9-2-1-3-10-14/h1-12,17H/b8-6+,16-12+.
What are the key properties of 2-[(E)-3-phenyliminoprop-1-enyl]phenol?
2-[(E)-3-phenyliminoprop-1-enyl]phenol has a molecular weight of 223.28 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-3-phenyliminoprop-1-enyl]phenol is sourced from PubChem (CID 135770174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).