2-(pyridine-3-carboximidoyl)phenol

C12H10N2O — CID 168995056

IUPAC2-(pyridine-3-carboximidoyl)phenol
SMILES[H]/N=C(\c1cccnc1)c1ccccc1O
InChIInChI=1S/C12H10N2O/c13-12(9-4-3-7-14-8-9)10-5-1-2-6-11(10)15/h1-8,13,15H/b13-12+
InChIKeyXFPHJEVMNIQEET-OUKQBFOZSA-N
MW198.23 g/mol
LogP2.20
Rot. Bonds2

About 2-(pyridine-3-carboximidoyl)phenol

2-(pyridine-3-carboximidoyl)phenol (PubChem CID 168995056) has the molecular formula C12H10N2O and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-(pyridine-3-carboximidoyl)phenol.

Molecular Properties

Compound Name2-(pyridine-3-carboximidoyl)phenol
PubChem CID168995056
Molecular FormulaC12H10N2O
Molecular Weight198.23 g/mol
Exact Mass198.08
IUPAC Name2-(pyridine-3-carboximidoyl)phenol
SMILES[H]/N=C(\c1cccnc1)c1ccccc1O
InChIInChI=1S/C12H10N2O/c13-12(9-4-3-7-14-8-9)10-5-1-2-6-11(10)15/h1-8,13,15H/b13-12+
InChIKeyXFPHJEVMNIQEET-OUKQBFOZSA-N
XLogP2.20
TPSA56.97 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(pyridine-3-carboximidoyl)phenol?
The IUPAC name of 2-(pyridine-3-carboximidoyl)phenol (CID 168995056) is 2-(pyridine-3-carboximidoyl)phenol.
What is the SMILES notation for 2-(pyridine-3-carboximidoyl)phenol?
The canonical SMILES for 2-(pyridine-3-carboximidoyl)phenol is [H]/N=C(\c1cccnc1)c1ccccc1O.
What is the InChIKey of 2-(pyridine-3-carboximidoyl)phenol?
The InChIKey is XFPHJEVMNIQEET-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H10N2O/c13-12(9-4-3-7-14-8-9)10-5-1-2-6-11(10)15/h1-8,13,15H/b13-12+.
What are the key properties of 2-(pyridine-3-carboximidoyl)phenol?
2-(pyridine-3-carboximidoyl)phenol has a molecular weight of 198.23 g/mol, XLogP of 2.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridine-3-carboximidoyl)phenol is sourced from PubChem (CID 168995056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).