4-Hydroxy-1-piperidinebutanethioamide
Basic information
- CAS
1016891-83-0- Standard SMILES
NC(=S)CCCN1CCC(O)CC1- InChIKey
XFAOJAZNSFFBTI-UHFFFAOYSA-N- Molecular formula
- C9H18N2OS
- Average molar mass
- 202.32 g/mol
- Monoisotopic mass
- 202.11398438
Names & identifiers
- Preferred name
- 4-Hydroxy-1-piperidinebutanethioamide
- IUPAC
- 4-(4-hydroxypiperidin-1-yl)butanethioamide
Names & synonyms
DTXSID0012876614-Hydroxy-1-piperidinebutanethioamideAKOS0001760781016891-83-04-(4-hydroxypiperidin-1-yl)butanethioamide
Database identifiers
- CAS
1016891-83-0- PubChem CID
- 24697487
- DTXSID
DTXSID001287661
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…