2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine

C20H15FN4 — CID 71762326

IUPAC2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine
SMILESCc1nnc(-c2ccc(-c3ccccn3)cc2)n1-c1ccccc1F
InChIInChI=1S/C20H15FN4/c1-14-23-24-20(25(14)19-8-3-2-6-17(19)21)16-11-9-15(10-12-16)18-7-4-5-13-22-18/h2-13H,1H3
InChIKeyWRYCGINDUVPELG-UHFFFAOYSA-N
MW330.37 g/mol
LogP4.44
Rot. Bonds3

About 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine

2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine (PubChem CID 71762326) has the molecular formula C20H15FN4 and a molecular weight of 330.37 g/mol. Its IUPAC name is 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine.

Molecular Properties

Compound Name2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine
PubChem CID71762326
Molecular FormulaC20H15FN4
Molecular Weight330.37 g/mol
Exact Mass330.13
IUPAC Name2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine
SMILESCc1nnc(-c2ccc(-c3ccccn3)cc2)n1-c1ccccc1F
InChIInChI=1S/C20H15FN4/c1-14-23-24-20(25(14)19-8-3-2-6-17(19)21)16-11-9-15(10-12-16)18-7-4-5-13-22-18/h2-13H,1H3
InChIKeyWRYCGINDUVPELG-UHFFFAOYSA-N
XLogP4.44
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine
CID 70588
3-biphenyl-4-yl-4-(2-fluorophenyl)-5-isopropyl-4H-1,2,4-triazole
CID 22019234
3-(6-fluoropyridin-3-yl)-2-(4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl)pyridine
CID 91618245
5-(3-(Difluoromethyl)-4-fluorophenyl)-3-((2-methyl-1H-imidazol-1-yl)methyl)pyridazine
CID 22240172
4-(4-Ethyl-5-((3-fluorobenzyl)thio)-4H-1,2,4-triazol-3-YL)pyridine
CID 931757
3-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-[1,2,4]triazol-3-yl)-1H-indol-3-yl]-piperidin-1-yl}-propionitrile
CID 9910451
5-[4-[[4-(2-Fluorophenyl)triazol-1-yl]methyl]phenyl]pyrimidine
CID 155527350
6-(4-Ethylphenyl)-2-phenylimidazo[1,2-b][1,2,4]triazine
CID 627189
2-Methyl-6-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
CID 1474430
N-methyl-4-phenyl-5-(1-phenyltetrazol-5-yl)pyrimidin-2-amine
CID 2801975
4-(4-Ethyl-5-((2-fluorobenzyl)thio)-4H-1,2,4-triazol-3-YL)pyridine
CID 933155
3-(4-Ethyl-5-((3-fluorobenzyl)thio)-4H-1,2,4-triazol-3-YL)pyridine
CID 933308

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine?
The IUPAC name of 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine (CID 71762326) is 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine.
What is the SMILES notation for 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine?
The canonical SMILES for 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine is Cc1nnc(-c2ccc(-c3ccccn3)cc2)n1-c1ccccc1F.
What is the InChIKey of 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine?
The InChIKey is WRYCGINDUVPELG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4/c1-14-23-24-20(25(14)19-8-3-2-6-17(19)21)16-11-9-15(10-12-16)18-7-4-5-13-22-18/h2-13H,1H3.
What are the key properties of 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine?
2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine has a molecular weight of 330.37 g/mol, XLogP of 4.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(2-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]phenyl]pyridine is sourced from PubChem (CID 71762326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).