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

C14H10FN3 — CID 22037203

IUPAC4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine
SMILESFc1cccc(-c2[nH]ncc2-c2ccncc2)c1
InChIInChI=1S/C14H10FN3/c15-12-3-1-2-11(8-12)14-13(9-17-18-14)10-4-6-16-7-5-10/h1-9H,(H,17,18)
InChIKeyZDYKSKKUSYCIRA-UHFFFAOYSA-N
MW239.25 g/mol
LogP3.28
Rot. Bonds2

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

4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine (PubChem CID 22037203) has the molecular formula C14H10FN3 and a molecular weight of 239.25 g/mol. Its IUPAC name is 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine
PubChem CID22037203
Molecular FormulaC14H10FN3
Molecular Weight239.25 g/mol
Exact Mass239.09
IUPAC Name4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine
SMILESFc1cccc(-c2[nH]ncc2-c2ccncc2)c1
InChIInChI=1S/C14H10FN3/c15-12-3-1-2-11(8-12)14-13(9-17-18-14)10-4-6-16-7-5-10/h1-9H,(H,17,18)
InChIKeyZDYKSKKUSYCIRA-UHFFFAOYSA-N
XLogP3.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine?
The IUPAC name of 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine (CID 22037203) is 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine.
What is the SMILES notation for 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine?
The canonical SMILES for 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine is Fc1cccc(-c2[nH]ncc2-c2ccncc2)c1.
What is the InChIKey of 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine?
The InChIKey is ZDYKSKKUSYCIRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3/c15-12-3-1-2-11(8-12)14-13(9-17-18-14)10-4-6-16-7-5-10/h1-9H,(H,17,18).
What are the key properties of 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine?
4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine has a molecular weight of 239.25 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine is sourced from PubChem (CID 22037203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).