Basic information
- CAS
1006461-44-4- Standard SMILES
CCn1nccc1C(C)NCc1cccc(OC)c1OC- InChIKey
CIERGNIMOCQPSV-UHFFFAOYSA-N- Molecular formula
- C16H23N3O2
- Average molar mass
- 289.37 g/mol
- Monoisotopic mass
- 289.17902698
Names & identifiers
- Preferred name
- N-[(2,3-Dimethoxyphenyl)methyl]-1-(1-ethyl-1H-pyrazol-5-yl)ethan-1-amine
- IUPAC
- N-[(2,3-dimethoxyphenyl)methyl]-1-(2-ethylpyrazol-3-yl)ethanamine
Names & synonyms
DTXSID7011448841006461-44-4N-[(2,3-Dimethoxyphenyl)methyl]-1-(1-ethyl-1H-pyrazol-5-yl)ethan-1-amineN-[(2,3-Dimethoxyphenyl)methyl]-1-ethyl-I+/--methyl-1H-pyrazole-5-methanamine
Database identifiers
- CAS
1006461-44-4- PubChem CID
- 19625152
- DTXSID
DTXSID701144884
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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