2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine

C18H20N4 — CID 95043592

IUPAC2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCN1CCC(c2nc3ccc(-c4ccccc4)cn3n2)CC1
InChIInChI=1S/C18H20N4/c1-21-11-9-15(10-12-21)18-19-17-8-7-16(13-22(17)20-18)14-5-3-2-4-6-14/h2-8,13,15H,9-12H2,1H3
InChIKeyBEPCDYJQOSZTKH-UHFFFAOYSA-N
MW292.39 g/mol
LogP3.21
Rot. Bonds2

About 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine

2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 95043592) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID95043592
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCN1CCC(c2nc3ccc(-c4ccccc4)cn3n2)CC1
InChIInChI=1S/C18H20N4/c1-21-11-9-15(10-12-21)18-19-17-8-7-16(13-22(17)20-18)14-5-3-2-4-6-14/h2-8,13,15H,9-12H2,1H3
InChIKeyBEPCDYJQOSZTKH-UHFFFAOYSA-N
XLogP3.21
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine (CID 95043592) is 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine is CN1CCC(c2nc3ccc(-c4ccccc4)cn3n2)CC1.
What is the InChIKey of 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is BEPCDYJQOSZTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c1-21-11-9-15(10-12-21)18-19-17-8-7-16(13-22(17)20-18)14-5-3-2-4-6-14/h2-8,13,15H,9-12H2,1H3.
What are the key properties of 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 292.39 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-4-yl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 95043592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).