7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine

C12H8ClN3 — CID 18446635

IUPAC7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine
SMILESClc1cccc2cc(-c3ccncc3)nn12
InChIInChI=1S/C12H8ClN3/c13-12-3-1-2-10-8-11(15-16(10)12)9-4-6-14-7-5-9/h1-8H
InChIKeyPPWGHXSPABVTJD-UHFFFAOYSA-N
MW229.67 g/mol
LogP3.05
Rot. Bonds1

About 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine

7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine (PubChem CID 18446635) has the molecular formula C12H8ClN3 and a molecular weight of 229.67 g/mol. Its IUPAC name is 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine
PubChem CID18446635
Molecular FormulaC12H8ClN3
Molecular Weight229.67 g/mol
Exact Mass229.04
IUPAC Name7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine
SMILESClc1cccc2cc(-c3ccncc3)nn12
InChIInChI=1S/C12H8ClN3/c13-12-3-1-2-10-8-11(15-16(10)12)9-4-6-14-7-5-9/h1-8H
InChIKeyPPWGHXSPABVTJD-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The IUPAC name of 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine (CID 18446635) is 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine is Clc1cccc2cc(-c3ccncc3)nn12.
What is the InChIKey of 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The InChIKey is PPWGHXSPABVTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3/c13-12-3-1-2-10-8-11(15-16(10)12)9-4-6-14-7-5-9/h1-8H.
What are the key properties of 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine?
7-chloro-2-pyridin-4-ylpyrazolo[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 7-chloro-2-pyridin-4-ylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 18446635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).