6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine

C16H20FN3 — CID 106882792

IUPAC6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2c(C)cc(C)cc2F)n1
InChIInChI=1S/C16H20FN3/c1-5-6-13-19-15(11(4)16(18)20-13)14-10(3)7-9(2)8-12(14)17/h7-8H,5-6H2,1-4H3,(H2,18,19,20)
InChIKeyXPRWXMDCENFEOT-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.74
Rot. Bonds3

About 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine

6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine (PubChem CID 106882792) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine
PubChem CID106882792
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC Name6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-c2c(C)cc(C)cc2F)n1
InChIInChI=1S/C16H20FN3/c1-5-6-13-19-15(11(4)16(18)20-13)14-10(3)7-9(2)8-12(14)17/h7-8H,5-6H2,1-4H3,(H2,18,19,20)
InChIKeyXPRWXMDCENFEOT-UHFFFAOYSA-N
XLogP3.74
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine 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 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine (CID 106882792) is 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine is CCCc1nc(N)c(C)c(-c2c(C)cc(C)cc2F)n1.
What is the InChIKey of 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine?
The InChIKey is XPRWXMDCENFEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-5-6-13-19-15(11(4)16(18)20-13)14-10(3)7-9(2)8-12(14)17/h7-8H,5-6H2,1-4H3,(H2,18,19,20).
What are the key properties of 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine?
6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine has a molecular weight of 273.35 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4,6-dimethylphenyl)-5-methyl-2-propylpyrimidin-4-amine is sourced from PubChem (CID 106882792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).