Basic information
- Standard SMILES
Cc1ccc(C(=O)O)nc1OCC1CC1- InChIKey
UJNJCZIFRGDHPQ-UHFFFAOYSA-N- Molecular formula
- C11H13NO3
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.08954328
Names & identifiers
- Preferred name
- 6-Cyclopropylmethoxy-5-methyl-pyridine-2-carboxylic acid
- IUPAC
- 6-(cyclopropylmethoxy)-5-methylpyridine-2-carboxylic acid
Names & synonyms
SCHEMBL14152215UJNJCZIFRGDHPQ-UHFFFAOYSA-N6-cyclopropylmethoxy-5-methyl-pyridine-2-carboxylic acid
Database identifiers
- PubChem CID
- 71087599
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 240
Related reactions
21 records
Compound notes
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