[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol

C15H17FN2O — CID 56710071

IUPAC[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol
SMILESCCCc1nc(C)cc(-c2ccc(F)c(CO)c2)n1
InChIInChI=1S/C15H17FN2O/c1-3-4-15-17-10(2)7-14(18-15)11-5-6-13(16)12(8-11)9-19/h5-8,19H,3-4,9H2,1-2H3
InChIKeyOYBPGLVIERXTQQ-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.04
Rot. Bonds4

About [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol

[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol (PubChem CID 56710071) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol
PubChem CID56710071
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol
SMILESCCCc1nc(C)cc(-c2ccc(F)c(CO)c2)n1
InChIInChI=1S/C15H17FN2O/c1-3-4-15-17-10(2)7-14(18-15)11-5-6-13(16)12(8-11)9-19/h5-8,19H,3-4,9H2,1-2H3
InChIKeyOYBPGLVIERXTQQ-UHFFFAOYSA-N
XLogP3.04
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol?
The IUPAC name of [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol (CID 56710071) is [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol.
What is the SMILES notation for [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol?
The canonical SMILES for [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol is CCCc1nc(C)cc(-c2ccc(F)c(CO)c2)n1.
What is the InChIKey of [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol?
The InChIKey is OYBPGLVIERXTQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-3-4-15-17-10(2)7-14(18-15)11-5-6-13(16)12(8-11)9-19/h5-8,19H,3-4,9H2,1-2H3.
What are the key properties of [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol?
[2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol has a molecular weight of 260.31 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-5-(6-methyl-2-propylpyrimidin-4-yl)phenyl]methanol is sourced from PubChem (CID 56710071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).