1-Acetyl-5-(cyclohexylmethyl)piperidine-3-carboxylic acid
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Basic information
- Standard SMILES
CC(=O)N1CC(CC2CCCCC2)CC(C(=O)O)C1- InChIKey
IAKHMBJVAGWGKK-UHFFFAOYSA-N- Molecular formula
- C15H25NO3
- Average molar mass
- 267.36 g/mol
Names & identifiers
- Preferred name
- 1-Acetyl-5-(cyclohexylmethyl)piperidine-3-carboxylic acid
- IUPAC
- 1-acetyl-5-(cyclohexylmethyl)piperidine-3-carboxylic acid
Names & synonyms
939410-81-8SCHEMBL9244021-acetyl-5-(cyclohexylmethyl)piperidine-3-carboxylic acidIAKHMBJVAGWGKK-UHFFFAOYSA-NDA-00553
Database identifiers
- PubChem CID
- 66844752
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 336
Related reactions
3 records
Compound notes
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