2-(2-methoxypyrimidin-5-yl)-5-methylphenol

C12H12N2O2 — CID 142614111

IUPAC2-(2-methoxypyrimidin-5-yl)-5-methylphenol
SMILESCOc1ncc(-c2ccc(C)cc2O)cn1
InChIInChI=1S/C12H12N2O2/c1-8-3-4-10(11(15)5-8)9-6-13-12(16-2)14-7-9/h3-7,15H,1-2H3
InChIKeySYVKKSULTNNRQA-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.17
Rot. Bonds2

About 2-(2-methoxypyrimidin-5-yl)-5-methylphenol

2-(2-methoxypyrimidin-5-yl)-5-methylphenol (PubChem CID 142614111) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-(2-methoxypyrimidin-5-yl)-5-methylphenol.

Molecular Properties

Compound Name2-(2-methoxypyrimidin-5-yl)-5-methylphenol
PubChem CID142614111
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-(2-methoxypyrimidin-5-yl)-5-methylphenol
SMILESCOc1ncc(-c2ccc(C)cc2O)cn1
InChIInChI=1S/C12H12N2O2/c1-8-3-4-10(11(15)5-8)9-6-13-12(16-2)14-7-9/h3-7,15H,1-2H3
InChIKeySYVKKSULTNNRQA-UHFFFAOYSA-N
XLogP2.17
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-methoxypyrimidin-5-yl)-5-methylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypyrimidin-5-yl)-5-methylphenol?
The IUPAC name of 2-(2-methoxypyrimidin-5-yl)-5-methylphenol (CID 142614111) is 2-(2-methoxypyrimidin-5-yl)-5-methylphenol.
What is the SMILES notation for 2-(2-methoxypyrimidin-5-yl)-5-methylphenol?
The canonical SMILES for 2-(2-methoxypyrimidin-5-yl)-5-methylphenol is COc1ncc(-c2ccc(C)cc2O)cn1.
What is the InChIKey of 2-(2-methoxypyrimidin-5-yl)-5-methylphenol?
The InChIKey is SYVKKSULTNNRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-3-4-10(11(15)5-8)9-6-13-12(16-2)14-7-9/h3-7,15H,1-2H3.
What are the key properties of 2-(2-methoxypyrimidin-5-yl)-5-methylphenol?
2-(2-methoxypyrimidin-5-yl)-5-methylphenol has a molecular weight of 216.24 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypyrimidin-5-yl)-5-methylphenol is sourced from PubChem (CID 142614111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).