7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

C10H6ClN5 — CID 16768400

IUPAC7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESClc1cc(-c2cccnc2)nc2ncnn12
InChIInChI=1S/C10H6ClN5/c11-9-4-8(7-2-1-3-12-5-7)15-10-13-6-14-16(9)10/h1-6H
InChIKeyBGGWRZJJRJTKIU-UHFFFAOYSA-N
MW231.65 g/mol
LogP1.84
Rot. Bonds1

About 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine

7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 16768400) has the molecular formula C10H6ClN5 and a molecular weight of 231.65 g/mol. Its IUPAC name is 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID16768400
Molecular FormulaC10H6ClN5
Molecular Weight231.65 g/mol
Exact Mass231.03
IUPAC Name7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESClc1cc(-c2cccnc2)nc2ncnn12
InChIInChI=1S/C10H6ClN5/c11-9-4-8(7-2-1-3-12-5-7)15-10-13-6-14-16(9)10/h1-6H
InChIKeyBGGWRZJJRJTKIU-UHFFFAOYSA-N
XLogP1.84
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.65
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine 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 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine (CID 16768400) is 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is Clc1cc(-c2cccnc2)nc2ncnn12.
What is the InChIKey of 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is BGGWRZJJRJTKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClN5/c11-9-4-8(7-2-1-3-12-5-7)15-10-13-6-14-16(9)10/h1-6H.
What are the key properties of 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine?
7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 231.65 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 16768400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).