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

C18H17FN4 — CID 59041044

IUPAC4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine
SMILESFc1ccc(-c2n[nH]c([C@H]3CCNC3)c2-c2ccncc2)cc1
InChIInChI=1S/C18H17FN4/c19-15-3-1-13(2-4-15)17-16(12-5-8-20-9-6-12)18(23-22-17)14-7-10-21-11-14/h1-6,8-9,14,21H,7,10-11H2,(H,22,23)/t14-/m0/s1
InChIKeyORCAZHDKLPGTMI-AWEZNQCLSA-N
MW308.36 g/mol
LogP3.35
Rot. Bonds3

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

4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine (PubChem CID 59041044) has the molecular formula C18H17FN4 and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine
PubChem CID59041044
Molecular FormulaC18H17FN4
Molecular Weight308.36 g/mol
Exact Mass308.14
IUPAC Name4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine
SMILESFc1ccc(-c2n[nH]c([C@H]3CCNC3)c2-c2ccncc2)cc1
InChIInChI=1S/C18H17FN4/c19-15-3-1-13(2-4-15)17-16(12-5-8-20-9-6-12)18(23-22-17)14-7-10-21-11-14/h1-6,8-9,14,21H,7,10-11H2,(H,22,23)/t14-/m0/s1
InChIKeyORCAZHDKLPGTMI-AWEZNQCLSA-N
XLogP3.35
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 ≤ 53.35
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)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexan-1-amine
CID 22037336
ethane;4-(3-phenyl-5-piperidin-4-yl-1H-pyrazol-4-yl)pyridine
CID 91131367
4-[3-(4-fluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazol-4-yl]pyridine
CID 22037247
4-(5-piperidin-4-yl-3-thiophen-3-yl-1H-pyrazol-4-yl)pyridine
CID 22953836
N-(4-fluorophenyl)-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidine-1-carboxamide
CID 68780763
(4-chlorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 91213482
1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclopentan-1-amine
CID 22953598
4-(3-phenyl-5-piperidin-4-yl-1H-pyrazol-4-yl)pyrimidine
CID 22973174
[5-(4-fluorophenyl)-2-piperidin-4-yl-4-pyridin-4-yl-1H-pyrrol-3-yl]methanol
CID 155235169
1-[5-(4-fluorophenyl)-2-piperidin-4-yl-4-pyridin-4-yl-1H-pyrrol-3-yl]ethanone
CID 155235302
2-(4-fluorophenyl)-6-piperidin-4-yl-3-pyridin-4-yl-1H-indole
CID 44565046

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine?
The IUPAC name of 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine (CID 59041044) is 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine.
What is the SMILES notation for 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine?
The canonical SMILES for 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine is Fc1ccc(-c2n[nH]c([C@H]3CCNC3)c2-c2ccncc2)cc1.
What is the InChIKey of 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine?
The InChIKey is ORCAZHDKLPGTMI-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H17FN4/c19-15-3-1-13(2-4-15)17-16(12-5-8-20-9-6-12)18(23-22-17)14-7-10-21-11-14/h1-6,8-9,14,21H,7,10-11H2,(H,22,23)/t14-/m0/s1.
What are the key properties of 4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine?
4-[3-(4-fluorophenyl)-5-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine has a molecular weight of 308.36 g/mol, XLogP of 3.35, 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-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl]pyridine is sourced from PubChem (CID 59041044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).