ethyl 4-(2-amino-2-phenylethyl)-5-methyl-1H-pyrazole-3-carboxylate
Basic information
- CAS
70291-73-5- Standard SMILES
CCOC(=O)c1n[nH]c(C)c1CC(N)c1ccccc1- InChIKey
YYMJRCDFZQRMSL-UHFFFAOYSA-N- Molecular formula
- C15H19N3O2
- Average molar mass
- 273.33 g/mol
- Monoisotopic mass
- 273.14772686
Names & identifiers
- Preferred name
- ethyl 4-(2-amino-2-phenylethyl)-5-methyl-1H-pyrazole-3-carboxylate
- IUPAC
- ethyl 4-(2-amino-2-phenylethyl)-5-methyl-1H-pyrazole-3-carboxylate
Names & synonyms
NSC33759470291-73-5ethyl 4-(2-amino-2-phenylethyl)-5-methyl-1H-pyrazole-3-carboxylateDTXSID60318850NSC-337594
Database identifiers
- CAS
70291-73-5- PubChem CID
- 333729
- DTXSID
DTXSID60318850
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 81 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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