4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride

C19H20Cl2N4 — CID 22037252

IUPAC4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride
SMILESCl.Clc1ccc(-c2n[nH]c(C3CCNCC3)c2-c2ccncc2)cc1
InChIInChI=1S/C19H19ClN4.ClH/c20-16-3-1-14(2-4-16)18-17(13-5-9-21-10-6-13)19(24-23-18)15-7-11-22-12-8-15;/h1-6,9-10,15,22H,7-8,11-12H2,(H,23,24);1H
InChIKeyKCEINTYJKIZEIZ-UHFFFAOYSA-N
MW375.30 g/mol
LogP4.68
Rot. Bonds3

About 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride

4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride (PubChem CID 22037252) has the molecular formula C19H20Cl2N4 and a molecular weight of 375.30 g/mol. Its IUPAC name is 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride.

Molecular Properties

Compound Name4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride
PubChem CID22037252
Molecular FormulaC19H20Cl2N4
Molecular Weight375.30 g/mol
Exact Mass374.11
IUPAC Name4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride
SMILESCl.Clc1ccc(-c2n[nH]c(C3CCNCC3)c2-c2ccncc2)cc1
InChIInChI=1S/C19H19ClN4.ClH/c20-16-3-1-14(2-4-16)18-17(13-5-9-21-10-6-13)19(24-23-18)15-7-11-22-12-8-15;/h1-6,9-10,15,22H,7-8,11-12H2,(H,23,24);1H
InChIKeyKCEINTYJKIZEIZ-UHFFFAOYSA-N
XLogP4.68
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.30
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride 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 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride?
The IUPAC name of 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride (CID 22037252) is 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride.
What is the SMILES notation for 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride?
The canonical SMILES for 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride is Cl.Clc1ccc(-c2n[nH]c(C3CCNCC3)c2-c2ccncc2)cc1.
What is the InChIKey of 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride?
The InChIKey is KCEINTYJKIZEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4.ClH/c20-16-3-1-14(2-4-16)18-17(13-5-9-21-10-6-13)19(24-23-18)15-7-11-22-12-8-15;/h1-6,9-10,15,22H,7-8,11-12H2,(H,23,24);1H.
What are the key properties of 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride?
4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride has a molecular weight of 375.30 g/mol, XLogP of 4.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-chlorophenyl)-5-piperidin-4-yl-1H-pyrazol-4-yl]pyridine;hydrochloride is sourced from PubChem (CID 22037252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).