phenyl(pyridazin-4-yl)methanol

C11H10N2O — CID 13205669

IUPACphenyl(pyridazin-4-yl)methanol
SMILESOC(c1ccccc1)c1ccnnc1
InChIInChI=1S/C11H10N2O/c14-11(9-4-2-1-3-5-9)10-6-7-12-13-8-10/h1-8,11,14H
InChIKeyVVELBHSXESOAMK-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.56
Rot. Bonds2

About phenyl(pyridazin-4-yl)methanol

phenyl(pyridazin-4-yl)methanol (PubChem CID 13205669) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is phenyl(pyridazin-4-yl)methanol.

Molecular Properties

Compound Namephenyl(pyridazin-4-yl)methanol
PubChem CID13205669
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Namephenyl(pyridazin-4-yl)methanol
SMILESOC(c1ccccc1)c1ccnnc1
InChIInChI=1S/C11H10N2O/c14-11(9-4-2-1-3-5-9)10-6-7-12-13-8-10/h1-8,11,14H
InChIKeyVVELBHSXESOAMK-UHFFFAOYSA-N
XLogP1.56
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl(pyridazin-4-yl)methanol?
The IUPAC name of phenyl(pyridazin-4-yl)methanol (CID 13205669) is phenyl(pyridazin-4-yl)methanol.
What is the SMILES notation for phenyl(pyridazin-4-yl)methanol?
The canonical SMILES for phenyl(pyridazin-4-yl)methanol is OC(c1ccccc1)c1ccnnc1.
What is the InChIKey of phenyl(pyridazin-4-yl)methanol?
The InChIKey is VVELBHSXESOAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-11(9-4-2-1-3-5-9)10-6-7-12-13-8-10/h1-8,11,14H.
What are the key properties of phenyl(pyridazin-4-yl)methanol?
phenyl(pyridazin-4-yl)methanol has a molecular weight of 186.21 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(pyridazin-4-yl)methanol is sourced from PubChem (CID 13205669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).