3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine

C9H5ClF3N3 — CID 1478737

IUPAC3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccn2)c(Cl)c1
InChIInChI=1S/C9H5ClF3N3/c10-7-4-6(9(11,12)13)5-14-8(7)16-3-1-2-15-16/h1-5H
InChIKeyXNEXBWDTYFOAHE-UHFFFAOYSA-N
MW247.61 g/mol
LogP2.94
Rot. Bonds1

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

3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine (PubChem CID 1478737) has the molecular formula C9H5ClF3N3 and a molecular weight of 247.61 g/mol. Its IUPAC name is 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine
PubChem CID1478737
Molecular FormulaC9H5ClF3N3
Molecular Weight247.61 g/mol
Exact Mass247.01
IUPAC Name3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cnc(-n2cccn2)c(Cl)c1
InChIInChI=1S/C9H5ClF3N3/c10-7-4-6(9(11,12)13)5-14-8(7)16-3-1-2-15-16/h1-5H
InChIKeyXNEXBWDTYFOAHE-UHFFFAOYSA-N
XLogP2.94
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.61
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-chloro-2-pyrazol-1-yl-5-(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

Related Compounds

3-chloro-2-(5-methylpyrazol-1-yl)-5-(trifluoromethyl)pyridine
CID 54945268
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine
CID 14821018
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrazole-4-sulfonyl chloride
CID 43531727
3-chloro-2-(3-chloropyrrol-1-yl)-5-(trifluoromethyl)pyridine
CID 54246481
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2,5-diazabicyclo[2.2.1]heptane
CID 166485300
1-[2-chloro-5-(trifluoromethyl)phenyl]pyrazole
CID 159868733
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-methylpyrazol-3-amine
CID 62677167
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrrole-2-carbonitrile
CID 3717416
3-chloro-2-[5-(chloromethyl)-1,2,4-triazol-1-yl]-5-(trifluoromethyl)pyridine
CID 107447281
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-propan-2-ylpyrazol-4-amine
CID 83216893
3-chloro-2-[4-(1,1,2,2-tetrafluoroethyl)imidazol-1-yl]-5-(trifluoromethyl)pyridine
CID 19892779
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]imidazole-4-carboxylic acid
CID 69085891

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine (CID 1478737) is 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine is FC(F)(F)c1cnc(-n2cccn2)c(Cl)c1.
What is the InChIKey of 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine?
The InChIKey is XNEXBWDTYFOAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClF3N3/c10-7-4-6(9(11,12)13)5-14-8(7)16-3-1-2-15-16/h1-5H.
What are the key properties of 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine?
3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine has a molecular weight of 247.61 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-pyrazol-1-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 1478737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).