2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine

C23H21F2N5 — CID 178078968

IUPAC2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
SMILESFc1ccc(-c2nn3cc(CN4CCN[C@@H](F)C4)ccc3c2-c2ccncc2)cc1
InChIInChI=1S/C23H21F2N5/c24-19-4-2-18(3-5-19)23-22(17-7-9-26-10-8-17)20-6-1-16(14-30(20)28-23)13-29-12-11-27-21(25)15-29/h1-10,14,21,27H,11-13,15H2/t21-/m1/s1
InChIKeyYHKFQHILFQRCAM-OAQYLSRUSA-N
MW405.45 g/mol
LogP3.90
Rot. Bonds4

About 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine

2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine (PubChem CID 178078968) has the molecular formula C23H21F2N5 and a molecular weight of 405.45 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
PubChem CID178078968
Molecular FormulaC23H21F2N5
Molecular Weight405.45 g/mol
Exact Mass405.18
IUPAC Name2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
SMILESFc1ccc(-c2nn3cc(CN4CCN[C@@H](F)C4)ccc3c2-c2ccncc2)cc1
InChIInChI=1S/C23H21F2N5/c24-19-4-2-18(3-5-19)23-22(17-7-9-26-10-8-17)20-6-1-16(14-30(20)28-23)13-29-12-11-27-21(25)15-29/h1-10,14,21,27H,11-13,15H2/t21-/m1/s1
InChIKeyYHKFQHILFQRCAM-OAQYLSRUSA-N
XLogP3.90
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]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

2-(4-fluorophenyl)-6-[[(3R)-3-methylpiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178079066
6-(cyclopropylmethyl)-2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178078966
6-bromo-2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178078886
methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate
CID 178078879
(2S)-2-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methylamino]propanoic acid
CID 178078983
(2R)-2-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methylamino]propanoic acid
CID 178079113
2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]morpholine
CID 178079124
[2-(4-chlorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methanamine
CID 178078943
2-(4-fluorophenyl)-N-piperidin-4-yl-3-pyridin-4-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 178079061
cis-(1R,3S)-3-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]cyclohexan-1-amine
CID 178079073
2-amino-2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]ethane-1,1,1-triol
CID 178079030
[2-(2,4-difluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methanamine
CID 178079110

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine (CID 178078968) is 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine is Fc1ccc(-c2nn3cc(CN4CCN[C@@H](F)C4)ccc3c2-c2ccncc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine?
The InChIKey is YHKFQHILFQRCAM-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H21F2N5/c24-19-4-2-18(3-5-19)23-22(17-7-9-26-10-8-17)20-6-1-16(14-30(20)28-23)13-29-12-11-27-21(25)15-29/h1-10,14,21,27H,11-13,15H2/t21-/m1/s1.
What are the key properties of 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine?
2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine has a molecular weight of 405.45 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 178078968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).