4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine

C15H16F3N3 — CID 118167040

IUPAC4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine
SMILESFC(F)(F)c1ccc(-n2nccc2C2CCNCC2)cc1
InChIInChI=1S/C15H16F3N3/c16-15(17,18)12-1-3-13(4-2-12)21-14(7-10-20-21)11-5-8-19-9-6-11/h1-4,7,10-11,19H,5-6,8-9H2
InChIKeyLZNDJPGTNVYRLK-UHFFFAOYSA-N
MW295.31 g/mol
LogP3.36
Rot. Bonds2

About 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine

4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine (PubChem CID 118167040) has the molecular formula C15H16F3N3 and a molecular weight of 295.31 g/mol. Its IUPAC name is 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine.

Molecular Properties

Compound Name4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine
PubChem CID118167040
Molecular FormulaC15H16F3N3
Molecular Weight295.31 g/mol
Exact Mass295.13
IUPAC Name4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine
SMILESFC(F)(F)c1ccc(-n2nccc2C2CCNCC2)cc1
InChIInChI=1S/C15H16F3N3/c16-15(17,18)12-1-3-13(4-2-12)21-14(7-10-20-21)11-5-8-19-9-6-11/h1-4,7,10-11,19H,5-6,8-9H2
InChIKeyLZNDJPGTNVYRLK-UHFFFAOYSA-N
XLogP3.36
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine 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

2,2,2-trifluoro-1-[4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidin-1-yl]ethanone
CID 130388018
3,3,3-trifluoro-2-hydroxy-2-methyl-1-[4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidin-1-yl]propan-1-one
CID 118166849
4-(5-cyclopropylpyrazol-1-yl)benzonitrile
CID 74891905
5-cyclopropyl-1-phenylpyrazole
CID 67206706
5-fluoro-3-piperidin-4-yl-1-[4-(trifluoromethyl)phenyl]indazole;hydrochloride
CID 14032601
3-[4-(5-cyclopropylpyrazol-1-yl)phenyl]-3-methylbutanoic acid
CID 117457936
4-(2-tert-butylpyrazol-3-yl)piperidine;dihydrochloride
CID 118167091
(3S)-3-[4-(trifluoromethyl)phenyl]pyrrolidine
CID 71742225
2-piperidin-4-yl-4-(trifluoromethyl)pyridine
CID 18413985
3,3,3-trifluoro-1-[4-[2-(4-fluorophenyl)pyrazol-3-yl]piperidin-1-yl]-2-hydroxy-2-methylpropan-1-one
CID 118167184
2-piperidin-4-yl-1-[[4-(trifluoromethyl)phenyl]methyl]indole
CID 91567280
(3S)-3-[4-(trifluoromethyl)phenyl]pyrrolidine;hydrochloride
CID 71742224

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine?
The IUPAC name of 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine (CID 118167040) is 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine.
What is the SMILES notation for 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine?
The canonical SMILES for 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine is FC(F)(F)c1ccc(-n2nccc2C2CCNCC2)cc1.
What is the InChIKey of 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine?
The InChIKey is LZNDJPGTNVYRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N3/c16-15(17,18)12-1-3-13(4-2-12)21-14(7-10-20-21)11-5-8-19-9-6-11/h1-4,7,10-11,19H,5-6,8-9H2.
What are the key properties of 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine?
4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine has a molecular weight of 295.31 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]piperidine is sourced from PubChem (CID 118167040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).