2-tert-Butyl-6-pyridin-4-ylethynyl-pyrazolo[1,5-a]pyrimidine

HCID 53239666
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)c1cc2ncc(C#Cc3ccncc3)cn2n1
InChIKey
XQHVMMHAZMQYTN-UHFFFAOYSA-N
Molecular formula
C17H16N4
Average molar mass
276.34 g/mol
Monoisotopic mass
276.13749653

Names & identifiers

Preferred name
2-tert-Butyl-6-pyridin-4-ylethynyl-pyrazolo[1,5-a]pyrimidine
IUPAC
2-tert-butyl-6-(2-pyridin-4-ylethynyl)pyrazolo[1,5-a]pyrimidine

Names & synonyms

SCHEMBL1989795XQHVMMHAZMQYTN-UHFFFAOYSA-N2-tert-Butyl-6-pyridin-4-ylethynyl-pyrazolo[1,5-a]pyrimidine

Database identifiers

PubChem CID
53239666

Properties

Computed structural properties

XLogP
3
Topological polar surface area
43.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21

Related reactions

3 records
New reaction record

Compound notes

Loading…