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Basic information
- Standard SMILES
CCOC(=O)C1CCN(Cc2cnc(N)s2)CC1- InChIKey
PSIPZVYUXNAJTG-UHFFFAOYSA-N- Molecular formula
- C12H19N3O2S
- Average molar mass
- 269.37 g/mol
- Monoisotopic mass
- 269.11979803
Names & identifiers
- Preferred name
- 1-(2-Amino-thiazol-5-ylmethyl)-piperidine-4-carboxylic acid ethyl ester
- IUPAC
- ethyl 1-[(2-amino-1,3-thiazol-5-yl)methyl]piperidine-4-carboxylate
Names & synonyms
SCHEMBL3772589PSIPZVYUXNAJTG-UHFFFAOYSA-NAKOS0183305101-(2-Amino-thiazol-5-ylmethyl)-piperidine-4-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 59610045
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Related reactions
2 records
Compound notes
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