4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine

C5H4F4N4O — CID 15010390

IUPAC4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
SMILESCNc1nc(F)nc(OC(F)(F)F)n1
InChIInChI=1S/C5H4F4N4O/c1-10-3-11-2(6)12-4(13-3)14-5(7,8)9/h1H3,(H,10,11,12,13)
InChIKeyNHSRJTGWJHSYJQ-UHFFFAOYSA-N
MW212.11 g/mol
LogP0.95
Rot. Bonds2

About 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine

4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine (PubChem CID 15010390) has the molecular formula C5H4F4N4O and a molecular weight of 212.11 g/mol. Its IUPAC name is 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
PubChem CID15010390
Molecular FormulaC5H4F4N4O
Molecular Weight212.11 g/mol
Exact Mass212.03
IUPAC Name4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
SMILESCNc1nc(F)nc(OC(F)(F)F)n1
InChIInChI=1S/C5H4F4N4O/c1-10-3-11-2(6)12-4(13-3)14-5(7,8)9/h1H3,(H,10,11,12,13)
InChIKeyNHSRJTGWJHSYJQ-UHFFFAOYSA-N
XLogP0.95
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.11
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-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 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine (CID 15010390) is 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine is CNc1nc(F)nc(OC(F)(F)F)n1.
What is the InChIKey of 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine?
The InChIKey is NHSRJTGWJHSYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4F4N4O/c1-10-3-11-2(6)12-4(13-3)14-5(7,8)9/h1H3,(H,10,11,12,13).
What are the key properties of 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine?
4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine has a molecular weight of 212.11 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 15010390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).