6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine

C20H23FN4 — CID 97447766

IUPAC6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCCN1CCC(c2nc3ccc(-c4cccc(F)c4)cn3n2)CC1
InChIInChI=1S/C20H23FN4/c1-2-10-24-11-8-15(9-12-24)20-22-19-7-6-17(14-25(19)23-20)16-4-3-5-18(21)13-16/h3-7,13-15H,2,8-12H2,1H3
InChIKeyMJOAXDCESFNFCC-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.12
Rot. Bonds4

About 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine

6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 97447766) has the molecular formula C20H23FN4 and a molecular weight of 338.43 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID97447766
Molecular FormulaC20H23FN4
Molecular Weight338.43 g/mol
Exact Mass338.19
IUPAC Name6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCCN1CCC(c2nc3ccc(-c4cccc(F)c4)cn3n2)CC1
InChIInChI=1S/C20H23FN4/c1-2-10-24-11-8-15(9-12-24)20-22-19-7-6-17(14-25(19)23-20)16-4-3-5-18(21)13-16/h3-7,13-15H,2,8-12H2,1H3
InChIKeyMJOAXDCESFNFCC-UHFFFAOYSA-N
XLogP4.12
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 97447766) is 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine is CCCN1CCC(c2nc3ccc(-c4cccc(F)c4)cn3n2)CC1.
What is the InChIKey of 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is MJOAXDCESFNFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN4/c1-2-10-24-11-8-15(9-12-24)20-22-19-7-6-17(14-25(19)23-20)16-4-3-5-18(21)13-16/h3-7,13-15H,2,8-12H2,1H3.
What are the key properties of 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine?
6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 338.43 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-2-(1-propylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 97447766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).