4-methyl-2,6-diphenylpyrimidin-5-ol

C17H14N2O — CID 135012179

IUPAC4-methyl-2,6-diphenylpyrimidin-5-ol
SMILESCc1nc(-c2ccccc2)nc(-c2ccccc2)c1O
InChIInChI=1S/C17H14N2O/c1-12-16(20)15(13-8-4-2-5-9-13)19-17(18-12)14-10-6-3-7-11-14/h2-11,20H,1H3
InChIKeyIEATWHHIYXFYIJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.82
Rot. Bonds2

About 4-methyl-2,6-diphenylpyrimidin-5-ol

4-methyl-2,6-diphenylpyrimidin-5-ol (PubChem CID 135012179) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 4-methyl-2,6-diphenylpyrimidin-5-ol.

Molecular Properties

Compound Name4-methyl-2,6-diphenylpyrimidin-5-ol
PubChem CID135012179
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name4-methyl-2,6-diphenylpyrimidin-5-ol
SMILESCc1nc(-c2ccccc2)nc(-c2ccccc2)c1O
InChIInChI=1S/C17H14N2O/c1-12-16(20)15(13-8-4-2-5-9-13)19-17(18-12)14-10-6-3-7-11-14/h2-11,20H,1H3
InChIKeyIEATWHHIYXFYIJ-UHFFFAOYSA-N
XLogP3.82
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2,6-diphenylpyrimidin-5-ol?
The IUPAC name of 4-methyl-2,6-diphenylpyrimidin-5-ol (CID 135012179) is 4-methyl-2,6-diphenylpyrimidin-5-ol.
What is the SMILES notation for 4-methyl-2,6-diphenylpyrimidin-5-ol?
The canonical SMILES for 4-methyl-2,6-diphenylpyrimidin-5-ol is Cc1nc(-c2ccccc2)nc(-c2ccccc2)c1O.
What is the InChIKey of 4-methyl-2,6-diphenylpyrimidin-5-ol?
The InChIKey is IEATWHHIYXFYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-12-16(20)15(13-8-4-2-5-9-13)19-17(18-12)14-10-6-3-7-11-14/h2-11,20H,1H3.
What are the key properties of 4-methyl-2,6-diphenylpyrimidin-5-ol?
4-methyl-2,6-diphenylpyrimidin-5-ol has a molecular weight of 262.31 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,6-diphenylpyrimidin-5-ol is sourced from PubChem (CID 135012179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).