2-Naphthalen-1-yl-6-piperidin-1-yl-2-propan-2-ylhexanenitrile
Basic information
- CAS
27602-07-9- Standard SMILES
CC(C)C(C#N)(CCCCN1CCCCC1)c1cccc2ccccc12- InChIKey
FBTKIOXGIZJFEF-UHFFFAOYSA-N- Molecular formula
- C24H32N2
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.25654903
Names & identifiers
- Preferred name
- 2-Naphthalen-1-yl-6-piperidin-1-yl-2-propan-2-ylhexanenitrile
- IUPAC
- 2-naphthalen-1-yl-6-piperidin-1-yl-2-propan-2-ylhexanenitrile
Names & synonyms
27602-07-9NSC1713652-naphthalen-1-yl-6-piperidin-1-yl-2-propan-2-ylhexanenitrileDTXSID10305654NSC-1713652-(naphthalen-1-yl)-6-(piperidin-1-yl)-2-(propan-2-yl)hexanenitrile
Database identifiers
- CAS
27602-07-9- PubChem CID
- 298974
- DTXSID
DTXSID10305654
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 470
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Compound notes
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