3,6-diphenyl-1,2,4-triazin-5-amine

C15H12N4 — CID 15532257

IUPAC3,6-diphenyl-1,2,4-triazin-5-amine
SMILESNc1nc(-c2ccccc2)nnc1-c1ccccc1
InChIInChI=1S/C15H12N4/c16-14-13(11-7-3-1-4-8-11)18-19-15(17-14)12-9-5-2-6-10-12/h1-10H,(H2,16,17,19)
InChIKeyFZIDITOOZDJIKL-UHFFFAOYSA-N
MW248.29 g/mol
LogP2.79
Rot. Bonds2

About 3,6-diphenyl-1,2,4-triazin-5-amine

3,6-diphenyl-1,2,4-triazin-5-amine (PubChem CID 15532257) has the molecular formula C15H12N4 and a molecular weight of 248.29 g/mol. Its IUPAC name is 3,6-diphenyl-1,2,4-triazin-5-amine.

Molecular Properties

Compound Name3,6-diphenyl-1,2,4-triazin-5-amine
PubChem CID15532257
Molecular FormulaC15H12N4
Molecular Weight248.29 g/mol
Exact Mass248.11
IUPAC Name3,6-diphenyl-1,2,4-triazin-5-amine
SMILESNc1nc(-c2ccccc2)nnc1-c1ccccc1
InChIInChI=1S/C15H12N4/c16-14-13(11-7-3-1-4-8-11)18-19-15(17-14)12-9-5-2-6-10-12/h1-10H,(H2,16,17,19)
InChIKeyFZIDITOOZDJIKL-UHFFFAOYSA-N
XLogP2.79
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-bromophenyl)-6-phenyl-1,2,4-triazin-5-amine
CID 6403257
3-[4-[4-(5,6-diphenyl-1,2,4-triazin-3-yl)phenyl]phenyl]-5,6-diphenyl-1,2,4-triazine;methane
CID 158126148
(3,6-diphenyl-1,2,4-triazin-5-yl)hydrazine
CID 6405036
5-(4-chlorophenyl)-3,6-diphenyl-1,2,4-triazine
CID 134997336
6-(4-chlorophenyl)-3-(2-fluorophenyl)-1,2,4-triazin-5-amine
CID 6405105
[6-(4-methylphenyl)-3-phenyl-1,2,4-triazin-5-yl]hydrazine
CID 6405039
5-bromo-6-chloro-3-phenylpyrazin-2-amine
CID 176898319
5-bromo-6-methyl-2-phenylpyrimidin-4-amine
CID 66304858
N,N-dimethyl-6-(4-methylphenyl)-3-phenyl-1,2,4-triazin-5-amine
CID 6403262
6-methylsulfanyl-3,5-diphenyl-1,2,4-triazine
CID 14740710
3-phenyl-1,2,4-triazin-5-amine
CID 15272334
2,3,5,8-tetraphenylpyrazino[2,3-d]pyridazine
CID 134914577

Frequently Asked Questions

What is the IUPAC name of 3,6-diphenyl-1,2,4-triazin-5-amine?
The IUPAC name of 3,6-diphenyl-1,2,4-triazin-5-amine (CID 15532257) is 3,6-diphenyl-1,2,4-triazin-5-amine.
What is the SMILES notation for 3,6-diphenyl-1,2,4-triazin-5-amine?
The canonical SMILES for 3,6-diphenyl-1,2,4-triazin-5-amine is Nc1nc(-c2ccccc2)nnc1-c1ccccc1.
What is the InChIKey of 3,6-diphenyl-1,2,4-triazin-5-amine?
The InChIKey is FZIDITOOZDJIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4/c16-14-13(11-7-3-1-4-8-11)18-19-15(17-14)12-9-5-2-6-10-12/h1-10H,(H2,16,17,19).
What are the key properties of 3,6-diphenyl-1,2,4-triazin-5-amine?
3,6-diphenyl-1,2,4-triazin-5-amine has a molecular weight of 248.29 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diphenyl-1,2,4-triazin-5-amine is sourced from PubChem (CID 15532257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).