Basic information
- Standard SMILES
CN(C)CC1CCN(c2cc(N)c(N)cc2Cl)C1- InChIKey
FIEFLFCOWHJDIT-UHFFFAOYSA-N- Molecular formula
- C13H21ClN4
- Average molar mass
- 268.78 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-5-(3-dimethylaminomethyl-pyrrolidin-1-yl)-benzene-1,2-diamine
- IUPAC
- 4-chloro-5-[3-[(dimethylamino)methyl]pyrrolidin-1-yl]benzene-1,2-diamine
Names & synonyms
SCHEMBL9899899FIEFLFCOWHJDIT-UHFFFAOYSA-N4-Chloro-5-(3-dimethylaminomethyl-pyrrolidin-1-yl)-benzene-1,2-diamine
Database identifiers
- PubChem CID
- 67957930
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 58.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 274
Related reactions
2 records
Compound notes
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