Basic information
- Standard SMILES
Cc1cc(Cl)cc(C)c1NC(=O)CN1CC=C(c2ccccn2)CC1- InChIKey
IYXPBLMULSFCEU-UHFFFAOYSA-N- Molecular formula
- C20H22ClN3O
- Average molar mass
- 355.9 g/mol
- Monoisotopic mass
- 355.14514
Names & identifiers
- Preferred name
- N-(4-chloro-2,6-dimethylphenyl)-2-(3',6'-dihydro-2,4'-bipyridin-1'(2'H)-yl)acetamide
- IUPAC
- N-(4-chloro-2,6-dimethylphenyl)-2-(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)acetamide
Names & synonyms
SCHEMBL4007220IYXPBLMULSFCEU-UHFFFAOYSA-NN-(4-chloro-2,6-dimethylphenyl)-2-(3',6'-dihydro-2,4'-bipyridin-1'(2'H)-yl)acetamide
Database identifiers
- PubChem CID
- 68874909
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 483
Related reactions
1 records
Compound notes
Loading…