5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine

C12H8ClN3 — CID 122540675

IUPAC5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESClc1ccc(-c2cccc3ncnn23)cc1
InChIInChI=1S/C12H8ClN3/c13-10-6-4-9(5-7-10)11-2-1-3-12-14-8-15-16(11)12/h1-8H
InChIKeyQNCJGXUDXWWAKZ-UHFFFAOYSA-N
MW229.67 g/mol
LogP3.05
Rot. Bonds1

About 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine

5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 122540675) has the molecular formula C12H8ClN3 and a molecular weight of 229.67 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID122540675
Molecular FormulaC12H8ClN3
Molecular Weight229.67 g/mol
Exact Mass229.04
IUPAC Name5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESClc1ccc(-c2cccc3ncnn23)cc1
InChIInChI=1S/C12H8ClN3/c13-10-6-4-9(5-7-10)11-2-1-3-12-14-8-15-16(11)12/h1-8H
InChIKeyQNCJGXUDXWWAKZ-UHFFFAOYSA-N
XLogP3.05
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.67
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-Chlorophenyl)-1-(1,1-dimethylethyl)-1H-pyrazolo(3,4-d)pyrimidin-4-amine
CID 4878
5,7-Dimethyl-2-phenylpyrazolo[1,5-a]pyrimidine
CID 737207
2-(4-Chlorophenyl)imidazo(1,2-a)pyridine
CID 745769
2-(4-Chlorophenyl)(1,2,4)triazolo(5,1-a)isoquinoline
CID 68866
1-Tert-Butyl-3-[(3-Chlorophenyl)methyl]-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
CID 59633494
2-(4-Chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
CID 738354
4-[6-(4-Chlorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]pyridine
CID 5329455
4-[3-(3-Chlorophenyl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329463
4-[3-(3-Chloro-4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329464
3-Chloro-5-(6-pyrazol-1-ylpyrimidin-4-yl)benzonitrile
CID 90646678
Phd-1-IN-1
CID 122540724
3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo(1,5-a)pyrimidin-5-amine
CID 6419789

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 122540675) is 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine is Clc1ccc(-c2cccc3ncnn23)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is QNCJGXUDXWWAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3/c13-10-6-4-9(5-7-10)11-2-1-3-12-14-8-15-16(11)12/h1-8H.
What are the key properties of 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine?
5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 229.67 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 122540675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).