2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine

C16H15N3O — CID 46833824

IUPAC2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccccc2)n2nc(C3CC3)nc12
InChIInChI=1S/C16H15N3O/c1-20-14-10-9-13(11-5-3-2-4-6-11)19-16(14)17-15(18-19)12-7-8-12/h2-6,9-10,12H,7-8H2,1H3
InChIKeyWKTXWSHVPSGHJA-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.28
Rot. Bonds3

About 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine

2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 46833824) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID46833824
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccccc2)n2nc(C3CC3)nc12
InChIInChI=1S/C16H15N3O/c1-20-14-10-9-13(11-5-3-2-4-6-11)19-16(14)17-15(18-19)12-7-8-12/h2-6,9-10,12H,7-8H2,1H3
InChIKeyWKTXWSHVPSGHJA-UHFFFAOYSA-N
XLogP3.28
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine (CID 46833824) is 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine is COc1ccc(-c2ccccc2)n2nc(C3CC3)nc12.
What is the InChIKey of 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is WKTXWSHVPSGHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-20-14-10-9-13(11-5-3-2-4-6-11)19-16(14)17-15(18-19)12-7-8-12/h2-6,9-10,12H,7-8H2,1H3.
What are the key properties of 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine?
2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 265.32 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 46833824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).