4-Piperidin-1-yl-but-2-enoic acid-HCl
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Basic information
- Standard SMILES
Cl.O=C(O)C=CCN1CCCCC1- InChIKey
DSQHWBRYZUFZDY-UHFFFAOYSA-N- Molecular formula
- C9H16ClNO2
- Average molar mass
- 205.68 g/mol
Names & identifiers
- Preferred name
- 4-Piperidin-1-yl-but-2-enoic acid-HCl
- IUPAC
- 4-piperidin-1-ylbut-2-enoic acid;hydrochloride
Names & synonyms
SCHEMBL6624060DSQHWBRYZUFZDY-UHFFFAOYSA-NSB355164-Piperidin-1-yl-but-2-enoic acid-HCl4-piperidin-1-yl-but-2-enoic acid -hcl4-(1-piperidyl)but-2-enoic acid;hydrochloride4-(piperidin-1-yl)-but-2-enoic acid hydrochloride
Database identifiers
- PubChem CID
- 69844167
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
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Related reactions
4 records
Compound notes
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