3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine

C16H10ClN5 — CID 139754200

IUPAC3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine
SMILESClc1ccc(-c2nn(-c3cnccn3)c3ncccc23)cc1
InChIInChI=1S/C16H10ClN5/c17-12-5-3-11(4-6-12)15-13-2-1-7-20-16(13)22(21-15)14-10-18-8-9-19-14/h1-10H
InChIKeyGQXOONHXCNOWLW-UHFFFAOYSA-N
MW307.74 g/mol
LogP3.53
Rot. Bonds2

About 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine

3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine (PubChem CID 139754200) has the molecular formula C16H10ClN5 and a molecular weight of 307.74 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine
PubChem CID139754200
Molecular FormulaC16H10ClN5
Molecular Weight307.74 g/mol
Exact Mass307.06
IUPAC Name3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine
SMILESClc1ccc(-c2nn(-c3cnccn3)c3ncccc23)cc1
InChIInChI=1S/C16H10ClN5/c17-12-5-3-11(4-6-12)15-13-2-1-7-20-16(13)22(21-15)14-10-18-8-9-19-14/h1-10H
InChIKeyGQXOONHXCNOWLW-UHFFFAOYSA-N
XLogP3.53
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.74
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine?
The IUPAC name of 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine (CID 139754200) is 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine is Clc1ccc(-c2nn(-c3cnccn3)c3ncccc23)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine?
The InChIKey is GQXOONHXCNOWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN5/c17-12-5-3-11(4-6-12)15-13-2-1-7-20-16(13)22(21-15)14-10-18-8-9-19-14/h1-10H.
What are the key properties of 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine?
3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine has a molecular weight of 307.74 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-1-pyrazin-2-ylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 139754200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).