Basic information
- Standard SMILES
Nc1ccc(OCc2ccc(Cl)nc2)cc1- InChIKey
NLYRPELHYCCULX-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2O
- Average molar mass
- 234.68 g/mol
- Monoisotopic mass
- 234.0559907
Names & identifiers
- Preferred name
- 4-(2-Chloro-5-pyridylmethyloxy)aniline
- IUPAC
- 4-[(6-chloro-3-pyridinyl)methoxy]aniline
Names & synonyms
SCHEMBL11246679NLYRPELHYCCULX-UHFFFAOYSA-N4-(2-chloro-5-pyridylmethyloxy)aniline2-chloro-5-(4-aminophenoxy)methylpyridine
Database identifiers
- PubChem CID
- 20537895
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 207
Related reactions
2 records
Compound notes
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