Basic information
- Standard SMILES
CCCCCCN1CCC(NC(=O)C2c3ccccc3Oc3ccccc32)CC1- InChIKey
ZSBQWSHGCMDNMD-UHFFFAOYSA-N- Molecular formula
- C25H32N2O2
- Average molar mass
- 392.5 g/mol
Names & identifiers
- Preferred name
- N-(1-hexylpiperidin-4-yl)xanthene-9-carboxamide
- IUPAC
- N-(1-hexylpiperidin-4-yl)-9H-xanthene-9-carboxamide
Names & synonyms
CHEMBL34226SCHEMBL8183907ZSBQWSHGCMDNMD-UHFFFAOYSA-NBDBM50098625N-(1-hexylpiperidin-4-yl)xanthene-9-carboxamide9H-Xanthene-9-carboxylic acid (1-hexyl-piperidin-4-yl)-amide
Database identifiers
- PubChem CID
- 11794863
- ChEMBL
CHEMBL34226- Nikkaji
- J1.540.248B
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 495
Related reactions
2 records
Compound notes
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