2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine

C10H5F6N3 — CID 18174934

IUPAC2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccn2)c(C(F)(F)F)c1
InChIInChI=1S/C10H5F6N3/c11-9(12,13)6-4-7(10(14,15)16)8(17-5-6)19-3-1-2-18-19/h1-5H
InChIKeyWVFOAKBYHOHCCN-UHFFFAOYSA-N
MW281.16 g/mol
LogP3.30
Rot. Bonds1

About 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine

2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine (PubChem CID 18174934) has the molecular formula C10H5F6N3 and a molecular weight of 281.16 g/mol. Its IUPAC name is 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine
PubChem CID18174934
Molecular FormulaC10H5F6N3
Molecular Weight281.16 g/mol
Exact Mass281.04
IUPAC Name2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccn2)c(C(F)(F)F)c1
InChIInChI=1S/C10H5F6N3/c11-9(12,13)6-4-7(10(14,15)16)8(17-5-6)19-3-1-2-18-19/h1-5H
InChIKeyWVFOAKBYHOHCCN-UHFFFAOYSA-N
XLogP3.30
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-pyrazol-1-yl-3,5-bis(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 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine?
The IUPAC name of 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine (CID 18174934) is 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine.
What is the SMILES notation for 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine?
The canonical SMILES for 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine is FC(F)(F)c1cnc(-n2cccn2)c(C(F)(F)F)c1.
What is the InChIKey of 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine?
The InChIKey is WVFOAKBYHOHCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5F6N3/c11-9(12,13)6-4-7(10(14,15)16)8(17-5-6)19-3-1-2-18-19/h1-5H.
What are the key properties of 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine?
2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine has a molecular weight of 281.16 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-3,5-bis(trifluoromethyl)pyridine is sourced from PubChem (CID 18174934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).