ethyl 5-(2-aminophenylamino)-1-methyl-1H-pyrazole-4-carboxylate

HCID 57555331

Basic information

Standard SMILES
CCOC(=O)c1cnn(C)c1Nc1ccccc1N
InChIKey
VLRMKYHACWWZEJ-UHFFFAOYSA-N
Molecular formula
C13H16N4O2
Average molar mass
260.29 g/mol

Names & identifiers

Preferred name
ethyl 5-(2-aminophenylamino)-1-methyl-1H-pyrazole-4-carboxylate
IUPAC
ethyl 5-(2-aminoanilino)-1-methylpyrazole-4-carboxylate

Names & synonyms

749226-94-6Ethyl 5-((2-aminophenyl)amino)-1-methyl-1H-pyrazole-4-carboxylateethyl 5-(2-aminophenylamino)-1-methyl-1H-pyrazole-4-carboxylateSCHEMBL1495921SCHEMBL30933993VLRMKYHACWWZEJ-UHFFFAOYSA-NDA-031075-(2-amino-phenylamino)-1-methyl-1H-pyrazole-4-carboxylic acid ethyl ester

Database identifiers

PubChem CID
57555331

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
82.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
19

Related reactions

4 records

Linked notes

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