2-(fluoromethyl)-1,3,5-triazine

C4H4FN3 — CID 57014060

IUPAC2-(fluoromethyl)-1,3,5-triazine
SMILESFCc1ncncn1
InChIInChI=1S/C4H4FN3/c5-1-4-7-2-6-3-8-4/h2-3H,1H2
InChIKeyRUHNNZGPHYPCRU-UHFFFAOYSA-N
MW113.09 g/mol
LogP0.34
Rot. Bonds1

About 2-(fluoromethyl)-1,3,5-triazine

2-(fluoromethyl)-1,3,5-triazine (PubChem CID 57014060) has the molecular formula C4H4FN3 and a molecular weight of 113.09 g/mol. Its IUPAC name is 2-(fluoromethyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(fluoromethyl)-1,3,5-triazine
PubChem CID57014060
Molecular FormulaC4H4FN3
Molecular Weight113.09 g/mol
Exact Mass113.04
IUPAC Name2-(fluoromethyl)-1,3,5-triazine
SMILESFCc1ncncn1
InChIInChI=1S/C4H4FN3/c5-1-4-7-2-6-3-8-4/h2-3H,1H2
InChIKeyRUHNNZGPHYPCRU-UHFFFAOYSA-N
XLogP0.34
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.09
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(fluoromethyl)-1,3,5-triazine 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-(fluoromethyl)-1,3,5-triazine?
The IUPAC name of 2-(fluoromethyl)-1,3,5-triazine (CID 57014060) is 2-(fluoromethyl)-1,3,5-triazine.
What is the SMILES notation for 2-(fluoromethyl)-1,3,5-triazine?
The canonical SMILES for 2-(fluoromethyl)-1,3,5-triazine is FCc1ncncn1.
What is the InChIKey of 2-(fluoromethyl)-1,3,5-triazine?
The InChIKey is RUHNNZGPHYPCRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4FN3/c5-1-4-7-2-6-3-8-4/h2-3H,1H2.
What are the key properties of 2-(fluoromethyl)-1,3,5-triazine?
2-(fluoromethyl)-1,3,5-triazine has a molecular weight of 113.09 g/mol, XLogP of 0.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1,3,5-triazine is sourced from PubChem (CID 57014060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).