4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine

C20H21FN4O — CID 119058126

IUPAC4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine
SMILESFc1ccccc1-n1cc(-c2ccncc2OCC2CCNCC2)cn1
InChIInChI=1S/C20H21FN4O/c21-18-3-1-2-4-19(18)25-13-16(11-24-25)17-7-10-23-12-20(17)26-14-15-5-8-22-9-6-15/h1-4,7,10-13,15,22H,5-6,8-9,14H2
InChIKeyGZSRUYQFWHDLJI-UHFFFAOYSA-N
MW352.41 g/mol
LogP3.45
Rot. Bonds5

About 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine

4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine (PubChem CID 119058126) has the molecular formula C20H21FN4O and a molecular weight of 352.41 g/mol. Its IUPAC name is 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine.

Molecular Properties

Compound Name4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine
PubChem CID119058126
Molecular FormulaC20H21FN4O
Molecular Weight352.41 g/mol
Exact Mass352.17
IUPAC Name4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine
SMILESFc1ccccc1-n1cc(-c2ccncc2OCC2CCNCC2)cn1
InChIInChI=1S/C20H21FN4O/c21-18-3-1-2-4-19(18)25-13-16(11-24-25)17-7-10-23-12-20(17)26-14-15-5-8-22-9-6-15/h1-4,7,10-13,15,22H,5-6,8-9,14H2
InChIKeyGZSRUYQFWHDLJI-UHFFFAOYSA-N
XLogP3.45
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.41
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine?
The IUPAC name of 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine (CID 119058126) is 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine.
What is the SMILES notation for 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine?
The canonical SMILES for 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine is Fc1ccccc1-n1cc(-c2ccncc2OCC2CCNCC2)cn1.
What is the InChIKey of 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine?
The InChIKey is GZSRUYQFWHDLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN4O/c21-18-3-1-2-4-19(18)25-13-16(11-24-25)17-7-10-23-12-20(17)26-14-15-5-8-22-9-6-15/h1-4,7,10-13,15,22H,5-6,8-9,14H2.
What are the key properties of 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine?
4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine has a molecular weight of 352.41 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-fluorophenyl)pyrazol-4-yl]-3-(piperidin-4-ylmethoxy)pyridine is sourced from PubChem (CID 119058126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).