Basic information
- Standard SMILES
CN[C@@H]1CCN(C(=O)C2CCN(C(C)=O)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1- InChIKey
IRVUSCWZURRRNI-QFBILLFUSA-N- Molecular formula
- C20H27Cl2N3O2
- Average molar mass
- 412.3 g/mol
Names & identifiers
- Preferred name
- (3R*,4R*)-1-[(1-acetylpiperidin-4-yl)carbonyl]-3-(3,4-dichlorophenyl)-N-methylpiperidin-4-amine
- IUPAC
- 1-[4-[(3R,4R)-3-(3,4-dichlorophenyl)-4-(methylamino)piperidine-1-carbonyl]piperidin-1-yl]ethanone
Names & synonyms
SCHEMBL1969048IRVUSCWZURRRNI-QFBILLFUSA-N(3R*,4R*)-1-[(1-acetylpiperidin-4-yl) carbonyl]-3-(3,4-dichlorophenyl)-N-methylpiperidine-4-amine(3R*,4R*)-1-[(1-acetylpiperidin-4-yl)carbonyl]-3-(3,4-dichlorophenyl)-N-methylpiperidin-4-amine(3R,4R)-1-[(1-acetylpiperidin-4-yl)carbonyl]-3-(3,4-dichlorophenyl)-N-methylpiperidin-4-amine
Database identifiers
- PubChem CID
- 57741761
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 539
Related reactions
14 records
Compound notes
Loading…