[2-(2-methylpyrimidin-4-yl)phenyl]methanol

C12H12N2O — CID 154273699

IUPAC[2-(2-methylpyrimidin-4-yl)phenyl]methanol
SMILESCc1nccc(-c2ccccc2CO)n1
InChIInChI=1S/C12H12N2O/c1-9-13-7-6-12(14-9)11-5-3-2-4-10(11)8-15/h2-7,15H,8H2,1H3
InChIKeySDQKHAOYXIKLON-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.94
Rot. Bonds2

About [2-(2-methylpyrimidin-4-yl)phenyl]methanol

[2-(2-methylpyrimidin-4-yl)phenyl]methanol (PubChem CID 154273699) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is [2-(2-methylpyrimidin-4-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-(2-methylpyrimidin-4-yl)phenyl]methanol
PubChem CID154273699
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name[2-(2-methylpyrimidin-4-yl)phenyl]methanol
SMILESCc1nccc(-c2ccccc2CO)n1
InChIInChI=1S/C12H12N2O/c1-9-13-7-6-12(14-9)11-5-3-2-4-10(11)8-15/h2-7,15H,8H2,1H3
InChIKeySDQKHAOYXIKLON-UHFFFAOYSA-N
XLogP1.94
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-methylpyrimidin-4-yl)phenyl]methanol?
The IUPAC name of [2-(2-methylpyrimidin-4-yl)phenyl]methanol (CID 154273699) is [2-(2-methylpyrimidin-4-yl)phenyl]methanol.
What is the SMILES notation for [2-(2-methylpyrimidin-4-yl)phenyl]methanol?
The canonical SMILES for [2-(2-methylpyrimidin-4-yl)phenyl]methanol is Cc1nccc(-c2ccccc2CO)n1.
What is the InChIKey of [2-(2-methylpyrimidin-4-yl)phenyl]methanol?
The InChIKey is SDQKHAOYXIKLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-13-7-6-12(14-9)11-5-3-2-4-10(11)8-15/h2-7,15H,8H2,1H3.
What are the key properties of [2-(2-methylpyrimidin-4-yl)phenyl]methanol?
[2-(2-methylpyrimidin-4-yl)phenyl]methanol has a molecular weight of 200.24 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylpyrimidin-4-yl)phenyl]methanol is sourced from PubChem (CID 154273699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).