Basic information
- Standard SMILES
Cc1ccc(C(=O)NCC2CC2)cc1-c1ccc2c(C3CCNCC3)noc2c1- InChIKey
JDYBZAWCXVIPKI-UHFFFAOYSA-N- Molecular formula
- C24H27N3O2
- Average molar mass
- 389.5 g/mol
Names & identifiers
- Preferred name
- N-(Cyclopropylmethyl)-4-methyl-3-(3-piperidin-4-yl-1,2-benzisoxazol-6-yl)benzamide
- IUPAC
- N-(cyclopropylmethyl)-4-methyl-3-(3-piperidin-4-yl-1,2-benzoxazol-6-yl)benzamide
Names & synonyms
SCHEMBL3527617JDYBZAWCXVIPKI-UHFFFAOYSA-NN-(Cyclopropylmethyl)-4-methyl-3-(3-piperidin-4-yl-1,2-benzisoxazol-6-yl)benzamide
Database identifiers
- PubChem CID
- 10475463
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 574
Related reactions
2 records
Compound notes
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