2-methyl-6-(trifluoromethyl)pyrimidin-4-amine

C6H6F3N3 — CID 23187061

IUPAC2-methyl-6-(trifluoromethyl)pyrimidin-4-amine
SMILESCc1nc(N)cc(C(F)(F)F)n1
InChIInChI=1S/C6H6F3N3/c1-3-11-4(6(7,8)9)2-5(10)12-3/h2H,1H3,(H2,10,11,12)
InChIKeyIADZCDBSYFRZME-UHFFFAOYSA-N
MW177.13 g/mol
LogP1.39
Rot. Bonds

About 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine

2-methyl-6-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 23187061) has the molecular formula C6H6F3N3 and a molecular weight of 177.13 g/mol. Its IUPAC name is 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(trifluoromethyl)pyrimidin-4-amine
PubChem CID23187061
Molecular FormulaC6H6F3N3
Molecular Weight177.13 g/mol
Exact Mass177.05
IUPAC Name2-methyl-6-(trifluoromethyl)pyrimidin-4-amine
SMILESCc1nc(N)cc(C(F)(F)F)n1
InChIInChI=1S/C6H6F3N3/c1-3-11-4(6(7,8)9)2-5(10)12-3/h2H,1H3,(H2,10,11,12)
InChIKeyIADZCDBSYFRZME-UHFFFAOYSA-N
XLogP1.39
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.13
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-6-(trifluoromethyl)pyrimidin-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 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine (CID 23187061) is 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine is Cc1nc(N)cc(C(F)(F)F)n1.
What is the InChIKey of 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is IADZCDBSYFRZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F3N3/c1-3-11-4(6(7,8)9)2-5(10)12-3/h2H,1H3,(H2,10,11,12).
What are the key properties of 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine?
2-methyl-6-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 177.13 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 23187061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).