7-Phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

HCID 1480415
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Basic information

Standard SMILES
N#Cc1cnn2c(-c3ccccc3)ccnc12
InChIKey
JEIMLAZQABXLEV-UHFFFAOYSA-N
Molecular formula
C13H8N4
Average molar mass
220.23 g/mol
Monoisotopic mass
220.07489627

Names & identifiers

Preferred name
7-Phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
IUPAC
7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

Names & synonyms

7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile72860-56-1MFCD00138880MLS000539475Kinome_3635Bionet2_000147SCHEMBL9468787CHEMBL1393571JEIMLAZQABXLEV-UHFFFAOYSA-NHMS1364G15HMS2160O09HMS3309A16
Show more names
AKOS015992177SMR0001251333-Cyano-7-phenylpyrazolo[1,5-a]pyrimidineDB-165768CS-03225271D-129

Database identifiers

PubChem CID
1480415
ChEMBL
CHEMBL1393571
Nikkaji
J2.202.853G

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
54 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17

Related reactions

4 records
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Compound notes

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