Basic information
- Standard SMILES
CCOC(=O)c1cn(Cc2ccc(OC)cc2)nc1C(=O)C1CC1- InChIKey
KKBGZSRVIORKRM-UHFFFAOYSA-N- Molecular formula
- C18H20N2O4
- Average molar mass
- 328.4 g/mol
Names & identifiers
- Preferred name
- ethyl 3-(cyclopropanecarbonyl)-1-(4-methoxybenzyl)-1H-pyrazole-4-carboxylate
- IUPAC
- ethyl 3-(cyclopropanecarbonyl)-1-[(4-methoxyphenyl)methyl]pyrazole-4-carboxylate
Names & synonyms
1235314-09-6SCHEMBL2507139KKBGZSRVIORKRM-UHFFFAOYSA-Nethyl 3-(cyclopropanecarbonyl)-1-(4-methoxybenzyl)-1H-pyrazole-4-carboxylateDA-46916
Database identifiers
- PubChem CID
- 67432976
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 458
Related reactions
1 records
Compound notes
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