N-(3-ethynylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide

HCID 57657904

Basic information

Standard SMILES
C#Cc1cccc(NC(=O)c2cc(C)nn2C)c1
InChIKey
LIKFPTSQRAKHOZ-UHFFFAOYSA-N
Molecular formula
C14H13N3O
Average molar mass
239.27 g/mol

Names & identifiers

Preferred name
N-(3-ethynylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
IUPAC
N-(3-ethynylphenyl)-2,5-dimethylpyrazole-3-carboxamide

Names & synonyms

N-(3-ethynylphenyl)-1,3-dimethyl-1H-pyrazole-5-carboxamideSCHEMBL834475LIKFPTSQRAKHOZ-UHFFFAOYSA-NAKOS010295970CCG-319729N-(3-ethynylphenyl)-2,5-dimethylpyrazole-3-carboxamideZ7342568482,5-Dimethyl-2H-pyrazole-3-carboxylic acid (3-ethynyl-phenyl)-amide

Database identifiers

PubChem CID
57657904

Properties

Computed structural properties

XLogP
2
Topological polar surface area
46.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18

Related reactions

29 records

Linked notes

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