[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol

C13H14N2O — CID 163317973

IUPAC[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol
SMILESCc1cnnc(-c2ccccc2CO)c1C
InChIInChI=1S/C13H14N2O/c1-9-7-14-15-13(10(9)2)12-6-4-3-5-11(12)8-16/h3-7,16H,8H2,1-2H3
InChIKeyGLHRMHJJOHQYNN-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.25
Rot. Bonds2

About [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol

[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol (PubChem CID 163317973) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol
PubChem CID163317973
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol
SMILESCc1cnnc(-c2ccccc2CO)c1C
InChIInChI=1S/C13H14N2O/c1-9-7-14-15-13(10(9)2)12-6-4-3-5-11(12)8-16/h3-7,16H,8H2,1-2H3
InChIKeyGLHRMHJJOHQYNN-UHFFFAOYSA-N
XLogP2.25
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(5-methyl-1,3-oxazol-4-yl)phenyl]methanol
CID 105443456
[2-(5-methylthiophen-2-yl)phenyl]methanol
CID 164647346
[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol
CID 56702750
[2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]methanol
CID 56709300
[2-[4-(dimethylamino)-5-methylpyrimidin-2-yl]phenyl]methanol
CID 74245573
[2-(6-methyl-2-phenylpyrimidin-4-yl)phenyl]methanol
CID 56719373
3-(2,4-dimethoxyphenyl)-4,5-dimethylpyridazine
CID 157011684
[2-(2-methylpyrimidin-4-yl)phenyl]methanol
CID 154273699
[2-[2-(methylaminomethyl)phenyl]phenyl]methanol
CID 70630718
[2-(hydroxymethyl)phenyl]methanol;methane
CID 143282166
[2-[5-[2-(hydroxymethyl)phenyl]furan-2-yl]phenyl]methanol
CID 11334991
3-(4-butan-2-ylphenyl)-4,5-dimethylpyridazine
CID 157019762

Frequently Asked Questions

What is the IUPAC name of [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol?
The IUPAC name of [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol (CID 163317973) is [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol.
What is the SMILES notation for [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol?
The canonical SMILES for [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol is Cc1cnnc(-c2ccccc2CO)c1C.
What is the InChIKey of [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol?
The InChIKey is GLHRMHJJOHQYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-7-14-15-13(10(9)2)12-6-4-3-5-11(12)8-16/h3-7,16H,8H2,1-2H3.
What are the key properties of [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol?
[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol has a molecular weight of 214.27 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol is sourced from PubChem (CID 163317973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).