4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine

C18H17FN4 — CID 22037247

IUPAC4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine
SMILESFc1ccc(-c2n[nH]c(C3CCCN3)c2-c2ccncc2)cc1
InChIInChI=1S/C18H17FN4/c19-14-5-3-13(4-6-14)17-16(12-7-10-20-11-8-12)18(23-22-17)15-2-1-9-21-15/h3-8,10-11,15,21H,1-2,9H2,(H,22,23)
InChIKeyUBPUTSUHUNLPJH-UHFFFAOYSA-N
MW308.36 g/mol
LogP3.70
Rot. Bonds3

About 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine

4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine (PubChem CID 22037247) has the molecular formula C18H17FN4 and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine
PubChem CID22037247
Molecular FormulaC18H17FN4
Molecular Weight308.36 g/mol
Exact Mass308.14
IUPAC Name4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine
SMILESFc1ccc(-c2n[nH]c(C3CCCN3)c2-c2ccncc2)cc1
InChIInChI=1S/C18H17FN4/c19-14-5-3-13(4-6-14)17-16(12-7-10-20-11-8-12)18(23-22-17)15-2-1-9-21-15/h3-8,10-11,15,21H,1-2,9H2,(H,22,23)
InChIKeyUBPUTSUHUNLPJH-UHFFFAOYSA-N
XLogP3.70
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[5-cyclopropyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine
CID 22262543
4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine
CID 59041044
4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexan-1-amine
CID 22037336
4-bromo-3-(4-methylsulfanylphenyl)-5-pyrrolidin-2-yl-1H-pyrazole
CID 84611715
4-bromo-3-(2,5-difluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazole
CID 84608392
4-bromo-3-(4-ethylphenyl)-5-pyrrolidin-2-yl-1H-pyrazole
CID 84604258
N-(4-fluorophenyl)-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 68780763
4-[(2R)-pyrrolidin-2-yl]pyridine;hydrochloride
CID 171195835
ethane;4-(3-phenyl-5-piperidin-4-yl-1H-pyrazol-4-yl)pyridine
CID 91131367
(4-chlorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 91213482
(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethanamine
CID 59038044
6-pyridin-4-yl-2-pyrrolidin-2-yl-1H-benzimidazole
CID 67062568

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine?
The IUPAC name of 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine (CID 22037247) is 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine.
What is the SMILES notation for 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine?
The canonical SMILES for 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine is Fc1ccc(-c2n[nH]c(C3CCCN3)c2-c2ccncc2)cc1.
What is the InChIKey of 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine?
The InChIKey is UBPUTSUHUNLPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4/c19-14-5-3-13(4-6-14)17-16(12-7-10-20-11-8-12)18(23-22-17)15-2-1-9-21-15/h3-8,10-11,15,21H,1-2,9H2,(H,22,23).
What are the key properties of 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine?
4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine has a molecular weight of 308.36 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine is sourced from PubChem (CID 22037247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).