2-{[5-amino-1-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]oxy}ethyl acetate

HCID 22282002
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Basic information

Standard SMILES
CC(=O)OCCOc1nn(C)c(N)c1-c1ccc(C)cc1
InChIKey
GFHFGEIRRHWWPC-UHFFFAOYSA-N
Molecular formula
C15H19N3O3
Average molar mass
289.33 g/mol
Monoisotopic mass
289.14264148

Names & identifiers

Preferred name
2-{[5-amino-1-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]oxy}ethyl acetate
IUPAC
2-[5-amino-1-methyl-4-(4-methylphenyl)pyrazol-3-yl]oxyethyl acetate

Names & synonyms

SCHEMBL6292817GFHFGEIRRHWWPC-UHFFFAOYSA-N2-{[5-amino-1-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]oxy}ethyl acetate

Database identifiers

PubChem CID
22282002

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
79.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21

Related reactions

12 records
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Linked notes

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