Basic information
- Standard SMILES
CC(C)Oc1nc(C(=O)O)cnc1N1CCCCC1- InChIKey
MDXAGYLCPMDYDL-UHFFFAOYSA-N- Molecular formula
- C13H19N3O3
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.14264148
Names & identifiers
- Preferred name
- 6-Isopropoxy-5-piperidin-1-yl-pyrazine-2-carboxylic acid
- IUPAC
- 5-piperidin-1-yl-6-propan-2-yloxypyrazine-2-carboxylic acid
Names & synonyms
SCHEMBL3255836MDXAGYLCPMDYDL-UHFFFAOYSA-N6-Isopropoxy-5-piperidin-1-yl-pyrazine-2-carboxylic acid
Database identifiers
- PubChem CID
- 68569451
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 306
Related reactions
3 records
Compound notes
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