Basic information
- Standard SMILES
CC(C)N1CCC(NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1- InChIKey
QQRYABPLZISIRW-UHFFFAOYSA-N- Molecular formula
- C19H25N3O
- Average molar mass
- 311.4 g/mol
Names & identifiers
- Preferred name
- 5-phenyl-1H-pyrrole-2-carboxylic acid (1-isopropyl-piperidin-4-yl)-amide
- IUPAC
- 5-phenyl-N-(1-propan-2-ylpiperidin-4-yl)-1H-pyrrole-2-carboxamide
Names & synonyms
QQRYABPLZISIRW-UHFFFAOYSA-N5-phenyl-1H-pyrrole-2-carboxylic acid (1-isopropyl-piperidin-4-yl)-amide
Database identifiers
- PubChem CID
- 86611037
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 384
Related reactions
4 records
Compound notes
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