Basic information
- Standard SMILES
CC(Oc1ccccc1)c1cc2n(n1)CCNC2- InChIKey
JRZKFYYABFSKGD-UHFFFAOYSA-N- Molecular formula
- C14H17N3O
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.13716217
Names & identifiers
- Preferred name
- rac-2-(1-Phenoxy-ethyl)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrazine
- IUPAC
- 2-(1-phenoxyethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
Names & synonyms
SCHEMBL9926462JRZKFYYABFSKGD-UHFFFAOYSA-Nrac-2-(1-Phenoxy-ethyl)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrazine
Database identifiers
- PubChem CID
- 67968152
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 39.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 268
Related reactions
2 records
Compound notes
Loading…