Basic information
- Standard SMILES
Cc1cc(I)ccc1NCCN1CCC(C)CC1- InChIKey
POEXMQBTTOHOMB-UHFFFAOYSA-N- Molecular formula
- C15H23IN2
- Average molar mass
- 358.26 g/mol
- Monoisotopic mass
- 358.0906
Names & identifiers
- Preferred name
- (4-Iodo-2-methylphenyl)-[2-(4-methylpiperidin-1-yl)ethyl]amine
- IUPAC
- 4-iodo-2-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]aniline
Names & synonyms
SCHEMBL4479804POEXMQBTTOHOMB-UHFFFAOYSA-N(4-iodo-2-methylphenyl)-[2-(4-methylpiperidin-1-yl)ethyl]amine
Database identifiers
- PubChem CID
- 69059102
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 239
Related reactions
4 records
Compound notes
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