5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C18H14FN5 — CID 59186193

IUPAC5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1cc(Nc2nc3cccc(-c4ccc(F)cc4)n3n2)ccn1
InChIInChI=1S/C18H14FN5/c1-12-11-15(9-10-20-12)21-18-22-17-4-2-3-16(24(17)23-18)13-5-7-14(19)8-6-13/h2-11H,1H3,(H,20,21,23)
InChIKeyXUKDMIORYGCHTJ-UHFFFAOYSA-N
MW319.34 g/mol
LogP3.98
Rot. Bonds3

About 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 59186193) has the molecular formula C18H14FN5 and a molecular weight of 319.34 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID59186193
Molecular FormulaC18H14FN5
Molecular Weight319.34 g/mol
Exact Mass319.12
IUPAC Name5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCc1cc(Nc2nc3cccc(-c4ccc(F)cc4)n3n2)ccn1
InChIInChI=1S/C18H14FN5/c1-12-11-15(9-10-20-12)21-18-22-17-4-2-3-16(24(17)23-18)13-5-7-14(19)8-6-13/h2-11H,1H3,(H,20,21,23)
InChIKeyXUKDMIORYGCHTJ-UHFFFAOYSA-N
XLogP3.98
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 59186193) is 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is Cc1cc(Nc2nc3cccc(-c4ccc(F)cc4)n3n2)ccn1.
What is the InChIKey of 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is XUKDMIORYGCHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5/c1-12-11-15(9-10-20-12)21-18-22-17-4-2-3-16(24(17)23-18)13-5-7-14(19)8-6-13/h2-11H,1H3,(H,20,21,23).
What are the key properties of 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 319.34 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 59186193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).