6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine

C15H10ClFN4 — CID 6405105

IUPAC6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine
SMILESNc1nc(-c2ccccc2F)nnc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H10ClFN4/c16-10-7-5-9(6-8-10)13-14(18)19-15(21-20-13)11-3-1-2-4-12(11)17/h1-8H,(H2,18,19,21)
InChIKeyFKGZWTPCKMEBHS-UHFFFAOYSA-N
MW300.72 g/mol
LogP3.58
Rot. Bonds2

About 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine

6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine (PubChem CID 6405105) has the molecular formula C15H10ClFN4 and a molecular weight of 300.72 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine.

Molecular Properties

Compound Name6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine
PubChem CID6405105
Molecular FormulaC15H10ClFN4
Molecular Weight300.72 g/mol
Exact Mass300.06
IUPAC Name6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine
SMILESNc1nc(-c2ccccc2F)nnc1-c1ccc(Cl)cc1
InChIInChI=1S/C15H10ClFN4/c16-10-7-5-9(6-8-10)13-14(18)19-15(21-20-13)11-3-1-2-4-12(11)17/h1-8H,(H2,18,19,21)
InChIKeyFKGZWTPCKMEBHS-UHFFFAOYSA-N
XLogP3.58
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.72
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-chlorophenyl)-3-(2-fluorophenyl)-5-(4-methylpiperazin-1-yl)-1,2,4-triazine
CID 52940447
3,6-diphenyl-1,2,4-triazin-5-amine
CID 15532257
5-(4-chlorophenyl)-3,6-diphenyl-1,2,4-triazine
CID 134997336
3-(2-fluorophenyl)-6-phenyl-5-piperidin-1-yl-1,2,4-triazine
CID 45035403
2-(4-chlorophenyl)-5-iodo-6-phenylpyrimidin-4-amine
CID 66294114
6-[3-(4-chlorophenyl)phenyl]-1,2,4-triazine-3,5-diamine
CID 121410399
3-(2-fluorophenyl)-6-phenyl-5-propoxy-1,2,4-triazine
CID 6409536
2-(4-chlorophenyl)-6-fluoroaniline
CID 107602778
1-(4-chlorophenyl)-3-(2-fluorophenyl)imidazo[1,5-a]pyridine
CID 132581655
3-(4-chlorophenyl)-2-(2-fluorophenyl)quinoline
CID 22399508
3-(2-chlorophenyl)-6-(4-chlorophenyl)-1,2,4,5-tetrazine
CID 849920
3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-amine
CID 6403257

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine?
The IUPAC name of 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine (CID 6405105) is 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine.
What is the SMILES notation for 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine?
The canonical SMILES for 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine is Nc1nc(-c2ccccc2F)nnc1-c1ccc(Cl)cc1.
What is the InChIKey of 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine?
The InChIKey is FKGZWTPCKMEBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN4/c16-10-7-5-9(6-8-10)13-14(18)19-15(21-20-13)11-3-1-2-4-12(11)17/h1-8H,(H2,18,19,21).
What are the key properties of 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine?
6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine has a molecular weight of 300.72 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine is sourced from PubChem (CID 6405105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).