7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine

C12H9ClN4 — CID 89472250

IUPAC7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccncc1-c1nc2cc(Cl)ccn2n1
InChIInChI=1S/C12H9ClN4/c1-8-2-4-14-7-10(8)12-15-11-6-9(13)3-5-17(11)16-12/h2-7H,1H3
InChIKeyRDMQRLKJFXRVCV-UHFFFAOYSA-N
MW244.69 g/mol
LogP2.75
Rot. Bonds1

About 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine

7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 89472250) has the molecular formula C12H9ClN4 and a molecular weight of 244.69 g/mol. Its IUPAC name is 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID89472250
Molecular FormulaC12H9ClN4
Molecular Weight244.69 g/mol
Exact Mass244.05
IUPAC Name7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccncc1-c1nc2cc(Cl)ccn2n1
InChIInChI=1S/C12H9ClN4/c1-8-2-4-14-7-10(8)12-15-11-6-9(13)3-5-17(11)16-12/h2-7H,1H3
InChIKeyRDMQRLKJFXRVCV-UHFFFAOYSA-N
XLogP2.75
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.69
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 89472250) is 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccncc1-c1nc2cc(Cl)ccn2n1.
What is the InChIKey of 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is RDMQRLKJFXRVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN4/c1-8-2-4-14-7-10(8)12-15-11-6-9(13)3-5-17(11)16-12/h2-7H,1H3.
What are the key properties of 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine?
7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 244.69 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(4-methyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 89472250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).