4-phenyl-2,6-di(pyrazol-1-yl)pyridine

C17H13N5 — CID 123601747

IUPAC4-phenyl-2,6-di(pyrazol-1-yl)pyridine
SMILESc1ccc(-c2cc(-n3cccn3)nc(-n3cccn3)c2)cc1
InChIInChI=1S/C17H13N5/c1-2-6-14(7-3-1)15-12-16(21-10-4-8-18-21)20-17(13-15)22-11-5-9-19-22/h1-13H
InChIKeyIWOCTKXXXPBLAP-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.12
Rot. Bonds3

About 4-phenyl-2,6-di(pyrazol-1-yl)pyridine

4-phenyl-2,6-di(pyrazol-1-yl)pyridine (PubChem CID 123601747) has the molecular formula C17H13N5 and a molecular weight of 287.33 g/mol. Its IUPAC name is 4-phenyl-2,6-di(pyrazol-1-yl)pyridine.

Molecular Properties

Compound Name4-phenyl-2,6-di(pyrazol-1-yl)pyridine
PubChem CID123601747
Molecular FormulaC17H13N5
Molecular Weight287.33 g/mol
Exact Mass287.12
IUPAC Name4-phenyl-2,6-di(pyrazol-1-yl)pyridine
SMILESc1ccc(-c2cc(-n3cccn3)nc(-n3cccn3)c2)cc1
InChIInChI=1S/C17H13N5/c1-2-6-14(7-3-1)15-12-16(21-10-4-8-18-21)20-17(13-15)22-11-5-9-19-22/h1-13H
InChIKeyIWOCTKXXXPBLAP-UHFFFAOYSA-N
XLogP3.12
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-phenylethenyl)-2,6-di(pyrazol-1-yl)pyridine
CID 123864479
5-phenyl-3-pyrazol-1-yl-1H-pyrazole
CID 173358488
4-chloro-2,6-di(pyrazol-1-yl)pyridine
CID 170900675
cobalt;2,6-di(pyrazol-1-yl)pyridine
CID 175285024
2,6-di(pyrazol-1-yl)pyridine;ethane
CID 144724019
2,6-di(pyrazol-1-yl)pyridine;ethane
CID 161004059
4-(2-phenyl-6-pyrazol-1-ylpyrimidin-4-yl)morpholine
CID 1378888
N-benzyl-2-phenyl-6-pyrazol-1-ylpyrimidin-4-amine
CID 796111
2,4,6-tris(5-phenyl-2-pyrazol-1-ylphenyl)-1,3,5-triazine
CID 174727426
2,6-di(pyrazol-1-yl)-4-(trifluoromethyl)pyridine
CID 170460067
N-(4-methylphenyl)-2-phenyl-6-pyrazol-1-ylpyrimidin-4-amine
CID 796113
CID 57339069
CID 57339069

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2,6-di(pyrazol-1-yl)pyridine?
The IUPAC name of 4-phenyl-2,6-di(pyrazol-1-yl)pyridine (CID 123601747) is 4-phenyl-2,6-di(pyrazol-1-yl)pyridine.
What is the SMILES notation for 4-phenyl-2,6-di(pyrazol-1-yl)pyridine?
The canonical SMILES for 4-phenyl-2,6-di(pyrazol-1-yl)pyridine is c1ccc(-c2cc(-n3cccn3)nc(-n3cccn3)c2)cc1.
What is the InChIKey of 4-phenyl-2,6-di(pyrazol-1-yl)pyridine?
The InChIKey is IWOCTKXXXPBLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5/c1-2-6-14(7-3-1)15-12-16(21-10-4-8-18-21)20-17(13-15)22-11-5-9-19-22/h1-13H.
What are the key properties of 4-phenyl-2,6-di(pyrazol-1-yl)pyridine?
4-phenyl-2,6-di(pyrazol-1-yl)pyridine has a molecular weight of 287.33 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2,6-di(pyrazol-1-yl)pyridine is sourced from PubChem (CID 123601747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).