Basic information
- Standard SMILES
O=C(O)c1cc(OCC2CC2)c(C2CC2)cn1- InChIKey
WCOAHUBZGBPHJH-UHFFFAOYSA-N- Molecular formula
- C13H15NO3
- Average molar mass
- 233.26 g/mol
Names & identifiers
- Preferred name
- 5-Cyclopropyl-4-cyclopropylmethoxy-pyridine-2-carboxylic acid
- IUPAC
- 5-cyclopropyl-4-(cyclopropylmethoxy)pyridine-2-carboxylic acid
Names & synonyms
1613238-50-8SCHEMBL15776512WCOAHUBZGBPHJH-UHFFFAOYSA-N5-cyclopropyl-4-cyclopropylmethoxy-pyridine-2-carboxylic acidDB-1184335-cyclopropyl-4-(cyclopropylmethoxy)picolinic acid
Database identifiers
- PubChem CID
- 90203809
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 299
Related reactions
13 records
Compound notes
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