2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine

C15H15N3O — CID 82566338

IUPAC2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(Cc2nc3cc(C)ccn3n2)cc1
InChIInChI=1S/C15H15N3O/c1-11-7-8-18-15(9-11)16-14(17-18)10-12-3-5-13(19-2)6-4-12/h3-9H,10H2,1-2H3
InChIKeyTYLZIDYUFAYBBI-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.64
Rot. Bonds3

About 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine

2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 82566338) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID82566338
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(Cc2nc3cc(C)ccn3n2)cc1
InChIInChI=1S/C15H15N3O/c1-11-7-8-18-15(9-11)16-14(17-18)10-12-3-5-13(19-2)6-4-12/h3-9H,10H2,1-2H3
InChIKeyTYLZIDYUFAYBBI-UHFFFAOYSA-N
XLogP2.64
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine (CID 82566338) is 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine is COc1ccc(Cc2nc3cc(C)ccn3n2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is TYLZIDYUFAYBBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-7-8-18-15(9-11)16-14(17-18)10-12-3-5-13(19-2)6-4-12/h3-9H,10H2,1-2H3.
What are the key properties of 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine?
2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 253.31 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)methyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 82566338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).