Basic information
- Standard SMILES
Nc1ncccc1-c1cnn(Cc2ccc(Oc3ccccc3)cc2)c1- InChIKey
MHHPWMRIOLNAKM-UHFFFAOYSA-N- Molecular formula
- C21H18N4O
- Average molar mass
- 342.4 g/mol
Names & identifiers
- Preferred name
- 3-(1-(4-Phenoxy-benzyl)-1H-pyrazol-4-yl)-pyridin-2-ylamine
- IUPAC
- 3-[1-[(4-phenoxyphenyl)methyl]pyrazol-4-yl]pyridin-2-amine
Names & synonyms
SCHEMBL510899MHHPWMRIOLNAKM-UHFFFAOYSA-N3-(1-(4-Phenoxy-benzyl)-1H-pyrazol-4-yl)-pyridin-2-ylamine
Database identifiers
- PubChem CID
- 59255264
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 420
Related reactions
5 records
Compound notes
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