4-fluoro-2-(3-phenyltriazol-4-yl)pyridine

C13H9FN4 — CID 102824567

IUPAC4-fluoro-2-(3-phenyltriazol-4-yl)pyridine
SMILESFc1ccnc(-c2cnnn2-c2ccccc2)c1
InChIInChI=1S/C13H9FN4/c14-10-6-7-15-12(8-10)13-9-16-17-18(13)11-4-2-1-3-5-11/h1-9H
InChIKeyNMZFQEJLTICXEL-UHFFFAOYSA-N
MW240.24 g/mol
LogP2.47
Rot. Bonds2

About 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine

4-fluoro-2-(3-phenyltriazol-4-yl)pyridine (PubChem CID 102824567) has the molecular formula C13H9FN4 and a molecular weight of 240.24 g/mol. Its IUPAC name is 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine.

Molecular Properties

Compound Name4-fluoro-2-(3-phenyltriazol-4-yl)pyridine
PubChem CID102824567
Molecular FormulaC13H9FN4
Molecular Weight240.24 g/mol
Exact Mass240.08
IUPAC Name4-fluoro-2-(3-phenyltriazol-4-yl)pyridine
SMILESFc1ccnc(-c2cnnn2-c2ccccc2)c1
InChIInChI=1S/C13H9FN4/c14-10-6-7-15-12(8-10)13-9-16-17-18(13)11-4-2-1-3-5-11/h1-9H
InChIKeyNMZFQEJLTICXEL-UHFFFAOYSA-N
XLogP2.47
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.24
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine 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

N-methyl-6-(3-phenyltriazol-4-yl)pyrimidin-4-amine
CID 114691010
6-(3-phenyltriazol-4-yl)pyrimidine-2,4-diamine
CID 106878720
2,5-difluoro-4-(3-phenyltriazol-4-yl)aniline
CID 107616039
1-methyl-5-(3-phenyltriazol-4-yl)triazole
CID 22215524
4-(3-phenyltriazol-4-yl)aniline
CID 53485501
2-ethyl-N-methyl-6-(3-phenyltriazol-4-yl)pyrimidin-4-amine
CID 114691056
5-(3-chloro-2,6-difluorophenyl)-1-phenyltriazole
CID 134343051
5-(2-bromophenyl)-1-phenyltriazole
CID 146164567
[2-(3-phenyltriazol-4-yl)phenyl]methanamine
CID 114689604
6-(3-phenyltriazol-4-yl)-2-propan-2-ylpyrimidin-4-amine
CID 114691047
1-[4-fluoro-3-(3-phenyltriazol-4-yl)phenyl]ethanamine
CID 114689809
(3-fluorophenyl)-(3-phenyltriazol-4-yl)methanol
CID 114684808

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine?
The IUPAC name of 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine (CID 102824567) is 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine.
What is the SMILES notation for 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine?
The canonical SMILES for 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine is Fc1ccnc(-c2cnnn2-c2ccccc2)c1.
What is the InChIKey of 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine?
The InChIKey is NMZFQEJLTICXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN4/c14-10-6-7-15-12(8-10)13-9-16-17-18(13)11-4-2-1-3-5-11/h1-9H.
What are the key properties of 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine?
4-fluoro-2-(3-phenyltriazol-4-yl)pyridine has a molecular weight of 240.24 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(3-phenyltriazol-4-yl)pyridine is sourced from PubChem (CID 102824567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).