2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine

C24H17F3N6 — CID 118651899

IUPAC2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine
SMILESCc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)[nH]n5)n4)c3)n2)n[nH]1
InChIInChI=1S/C24H17F3N6/c1-14-11-21(31-30-14)19-9-3-7-17(28-19)15-5-2-6-16(12-15)18-8-4-10-20(29-18)22-13-23(33-32-22)24(25,26)27/h2-13H,1H3,(H,30,31)(H,32,33)
InChIKeyBNEPJPDOQFWENF-UHFFFAOYSA-N
MW446.44 g/mol
LogP5.92
Rot. Bonds4

About 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine

2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine (PubChem CID 118651899) has the molecular formula C24H17F3N6 and a molecular weight of 446.44 g/mol. Its IUPAC name is 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine.

Molecular Properties

Compound Name2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine
PubChem CID118651899
Molecular FormulaC24H17F3N6
Molecular Weight446.44 g/mol
Exact Mass446.15
IUPAC Name2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine
SMILESCc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)[nH]n5)n4)c3)n2)n[nH]1
InChIInChI=1S/C24H17F3N6/c1-14-11-21(31-30-14)19-9-3-7-17(28-19)15-5-2-6-16(12-15)18-8-4-10-20(29-18)22-13-23(33-32-22)24(25,26)27/h2-13H,1H3,(H,30,31)(H,32,33)
InChIKeyBNEPJPDOQFWENF-UHFFFAOYSA-N
XLogP5.92
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.44
LogP ≤ 55.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine?
The IUPAC name of 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine (CID 118651899) is 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine.
What is the SMILES notation for 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine?
The canonical SMILES for 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine is Cc1cc(-c2cccc(-c3cccc(-c4cccc(-c5cc(C(F)(F)F)[nH]n5)n4)c3)n2)n[nH]1.
What is the InChIKey of 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine?
The InChIKey is BNEPJPDOQFWENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F3N6/c1-14-11-21(31-30-14)19-9-3-7-17(28-19)15-5-2-6-16(12-15)18-8-4-10-20(29-18)22-13-23(33-32-22)24(25,26)27/h2-13H,1H3,(H,30,31)(H,32,33).
What are the key properties of 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine?
2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine has a molecular weight of 446.44 g/mol, XLogP of 5.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-pyrazol-3-yl)-6-[3-[6-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-2-pyridinyl]phenyl]pyridine is sourced from PubChem (CID 118651899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).