Basic information
- Standard SMILES
CC(=O)CCCn1c(NC2CCNCC2)nc2ccccc21.I- InChIKey
MQVDJFUCELBZSM-UHFFFAOYSA-N- Molecular formula
- C17H25IN4O
- Average molar mass
- 428.3 g/mol
- Monoisotopic mass
- 428.10731
Names & identifiers
- Preferred name
- (1-(4-Oxopentyl)-1H-benzimidazol-2-yl)(piperidin-4-yl)amine Hydriodic Acid Salt
- IUPAC
- 5-[2-(piperidin-4-ylamino)benzimidazol-1-yl]pentan-2-one;hydroiodide
Names & synonyms
MQVDJFUCELBZSM-UHFFFAOYSA-N(1-(4-Oxopentyl)-1H-benzimidazol-2-yl)(piperidin-4-yl)amine Hydriodic Acid Salt
Database identifiers
- PubChem CID
- 86756597
Properties
Computed structural properties
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 370
Related reactions
2 records
Compound notes
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