Basic information
- Standard SMILES
Nc1cccc(COCc2cccc(Cl)c2)n1- InChIKey
PRWQMHRICYRROL-UHFFFAOYSA-N- Molecular formula
- C13H13ClN2O
- Average molar mass
- 248.71 g/mol
- Monoisotopic mass
- 248.0716407
Names & identifiers
- Preferred name
- 6-(3-Chloro-benzyloxymethyl)-pyridin-2-ylamine
- IUPAC
- 6-[(3-chlorophenyl)methoxymethyl]pyridin-2-amine
Names & synonyms
SCHEMBL3925991PRWQMHRICYRROL-UHFFFAOYSA-NAKOS0177918526-(3-Chloro-benzyloxymethyl)-pyridin-2-ylamine
Database identifiers
- PubChem CID
- 68842011
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 227
Related reactions
6 records
Linked notes
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