2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine

C10H8N6 — CID 118591414

IUPAC2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine
SMILESc1ccc(-c2cn(-c3ccn[nH]3)nn2)nc1
InChIInChI=1S/C10H8N6/c1-2-5-11-8(3-1)9-7-16(15-13-9)10-4-6-12-14-10/h1-7H,(H,12,14)
InChIKeyQUBDFZFZLHFFKF-UHFFFAOYSA-N
MW212.22 g/mol
LogP1.05
Rot. Bonds2

About 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine

2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine (PubChem CID 118591414) has the molecular formula C10H8N6 and a molecular weight of 212.22 g/mol. Its IUPAC name is 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine.

Molecular Properties

Compound Name2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine
PubChem CID118591414
Molecular FormulaC10H8N6
Molecular Weight212.22 g/mol
Exact Mass212.08
IUPAC Name2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine
SMILESc1ccc(-c2cn(-c3ccn[nH]3)nn2)nc1
InChIInChI=1S/C10H8N6/c1-2-5-11-8(3-1)9-7-16(15-13-9)10-4-6-12-14-10/h1-7H,(H,12,14)
InChIKeyQUBDFZFZLHFFKF-UHFFFAOYSA-N
XLogP1.05
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[1-(1H-pyrazol-5-yl)triazol-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

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine?
The IUPAC name of 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine (CID 118591414) is 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine.
What is the SMILES notation for 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine?
The canonical SMILES for 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine is c1ccc(-c2cn(-c3ccn[nH]3)nn2)nc1.
What is the InChIKey of 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine?
The InChIKey is QUBDFZFZLHFFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6/c1-2-5-11-8(3-1)9-7-16(15-13-9)10-4-6-12-14-10/h1-7H,(H,12,14).
What are the key properties of 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine?
2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine has a molecular weight of 212.22 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1H-pyrazol-5-yl)triazol-4-yl]pyridine is sourced from PubChem (CID 118591414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).