4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine

C15H19N3O — CID 46204538

IUPAC4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine
SMILESOn1cc(C2CCNCC2)c(Cc2ccccc2)n1
InChIInChI=1S/C15H19N3O/c19-18-11-14(13-6-8-16-9-7-13)15(17-18)10-12-4-2-1-3-5-12/h1-5,11,13,16,19H,6-10H2
InChIKeyWQXQQWPMVZCNML-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.18
Rot. Bonds3

About 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine

4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine (PubChem CID 46204538) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine.

Molecular Properties

Compound Name4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine
PubChem CID46204538
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine
SMILESOn1cc(C2CCNCC2)c(Cc2ccccc2)n1
InChIInChI=1S/C15H19N3O/c19-18-11-14(13-6-8-16-9-7-13)15(17-18)10-12-4-2-1-3-5-12/h1-5,11,13,16,19H,6-10H2
InChIKeyWQXQQWPMVZCNML-UHFFFAOYSA-N
XLogP2.18
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

Analyze 4-(3-benzyl-1-hydroxypyrazol-4-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

4-[3-[[4-(3,5-difluorophenyl)phenyl]methyl]-1-hydroxypyrazol-4-yl]piperidine
CID 166090519
4-[3-[(7-ethylnaphthalen-2-yl)methyl]-1-hydroxypyrazol-4-yl]piperidine
CID 177245975
4-[3-[(4-fluoro-3-methylphenyl)methyl]-1-hydroxypyrazol-4-yl]piperidine
CID 166090460
4-[3-[(4-chloro-3-methylphenyl)methyl]-1-hydroxypyrazol-4-yl]piperidine
CID 166090482
4-(3-ethyl-1-phenylpyrazol-4-yl)piperidine
CID 174757890
4-(4-benzyl-1-methylpyrazol-5-yl)piperidine
CID 18686313
4-(3-benzyl-1-methylpyrazol-5-yl)piperidine
CID 18187656
2-benzyl-5-piperidin-4-yl-1,3-thiazole
CID 18187536
4-(3-benzyl-1-propylpyrazol-5-yl)piperidine
CID 18187520
4-(2-benzyl-1H-imidazol-5-yl)piperidine
CID 18461127
4-[1-(2-phenylethyl)pyrazol-4-yl]piperidine
CID 122240912
5-benzyl-2-methyl-4-piperidin-4-ylpyrimidine
CID 118759817

Frequently Asked Questions

What is the IUPAC name of 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine?
The IUPAC name of 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine (CID 46204538) is 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine.
What is the SMILES notation for 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine?
The canonical SMILES for 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine is On1cc(C2CCNCC2)c(Cc2ccccc2)n1.
What is the InChIKey of 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine?
The InChIKey is WQXQQWPMVZCNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c19-18-11-14(13-6-8-16-9-7-13)15(17-18)10-12-4-2-1-3-5-12/h1-5,11,13,16,19H,6-10H2.
What are the key properties of 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine?
4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine has a molecular weight of 257.34 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-benzyl-1-hydroxypyrazol-4-yl)piperidine is sourced from PubChem (CID 46204538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).