Basic information
- CAS
184970-31-8- Standard SMILES
S=C1CCCN1C1CCNCC1- InChIKey
WGOPVPYAPHGEFD-UHFFFAOYSA-N- Molecular formula
- C9H16N2S
- Average molar mass
- 184.3 g/mol
- Monoisotopic mass
- 184.10341969
Names & identifiers
- Preferred name
- 1-(4-Piperidinyl)-2-pyrrolidinethione
- IUPAC
- 1-piperidin-4-ylpyrrolidine-2-thione
Names & synonyms
SCHEMBL8912212SCHEMBL8912218DTXSID9012858121-(4-Piperidinyl)-2-pyrrolidinethione1-(Piperidin-4-yl)pyrrolidine-2-thione184970-31-8
Database identifiers
- CAS
184970-31-8- PubChem CID
- 85706643
- DTXSID
DTXSID901285812
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 47.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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