[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol

C13H15N3O — CID 71058174

IUPAC[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol
SMILESCCc1nc(C)nc(-c2ccc(CO)cc2)n1
InChIInChI=1S/C13H15N3O/c1-3-12-14-9(2)15-13(16-12)11-6-4-10(8-17)5-7-11/h4-7,17H,3,8H2,1-2H3
InChIKeyAFJQCUVBZAHZHI-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.90
Rot. Bonds3

About [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol

[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol (PubChem CID 71058174) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol
PubChem CID71058174
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol
SMILESCCc1nc(C)nc(-c2ccc(CO)cc2)n1
InChIInChI=1S/C13H15N3O/c1-3-12-14-9(2)15-13(16-12)11-6-4-10(8-17)5-7-11/h4-7,17H,3,8H2,1-2H3
InChIKeyAFJQCUVBZAHZHI-UHFFFAOYSA-N
XLogP1.90
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol?
The IUPAC name of [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol (CID 71058174) is [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol.
What is the SMILES notation for [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol?
The canonical SMILES for [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol is CCc1nc(C)nc(-c2ccc(CO)cc2)n1.
What is the InChIKey of [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol?
The InChIKey is AFJQCUVBZAHZHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-3-12-14-9(2)15-13(16-12)11-6-4-10(8-17)5-7-11/h4-7,17H,3,8H2,1-2H3.
What are the key properties of [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol?
[4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol has a molecular weight of 229.28 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethyl-6-methyl-1,3,5-triazin-2-yl)phenyl]methanol is sourced from PubChem (CID 71058174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).