5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine

C9H8F3N3 — CID 175981246

IUPAC5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(N2CCC=N2)cn1
InChIInChI=1S/C9H8F3N3/c10-9(11,12)8-3-2-7(6-13-8)15-5-1-4-14-15/h2-4,6H,1,5H2
InChIKeyRGKATAHOKWSBKT-UHFFFAOYSA-N
MW215.18 g/mol
LogP2.30
Rot. Bonds1

About 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine

5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine (PubChem CID 175981246) has the molecular formula C9H8F3N3 and a molecular weight of 215.18 g/mol. Its IUPAC name is 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine
PubChem CID175981246
Molecular FormulaC9H8F3N3
Molecular Weight215.18 g/mol
Exact Mass215.07
IUPAC Name5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(N2CCC=N2)cn1
InChIInChI=1S/C9H8F3N3/c10-9(11,12)8-3-2-7(6-13-8)15-5-1-4-14-15/h2-4,6H,1,5H2
InChIKeyRGKATAHOKWSBKT-UHFFFAOYSA-N
XLogP2.30
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.18
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)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 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine?
The IUPAC name of 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine (CID 175981246) is 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine?
The canonical SMILES for 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(N2CCC=N2)cn1.
What is the InChIKey of 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine?
The InChIKey is RGKATAHOKWSBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3/c10-9(11,12)8-3-2-7(6-13-8)15-5-1-4-14-15/h2-4,6H,1,5H2.
What are the key properties of 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine?
5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine has a molecular weight of 215.18 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dihydropyrazol-2-yl)-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 175981246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).