Basic information
- Standard SMILES
CC1CN(c2ccc(Cl)c(N)c2)CC(C)N1- InChIKey
QGNNEILGRBUAMD-UHFFFAOYSA-N- Molecular formula
- C12H18ClN3
- Average molar mass
- 239.74 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-5-(3,5-dimethylpiperazin-1-yl)aniline
- IUPAC
- 2-chloro-5-(3,5-dimethylpiperazin-1-yl)aniline
Names & synonyms
SCHEMBL4801586
Database identifiers
- PubChem CID
- 69196843
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 226
Related reactions
3 records
Compound notes
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