Basic information
- Standard SMILES
COC(=O)c1cnc(-c2ccncc2)nc1- InChIKey
IFMDNZAQBZVFOL-UHFFFAOYSA-N- Molecular formula
- C11H9N3O2
- Average molar mass
- 215.21 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(pyridin-4-yl)pyrimidine-5-carboxylate
- IUPAC
- methyl 2-pyridin-4-ylpyrimidine-5-carboxylate
Names & synonyms
methyl 2-(pyridin-4-yl)pyrimidine-5-carboxylateSCHEMBL4636333IFMDNZAQBZVFOL-UHFFFAOYSA-N933988-17-12-pyridin-4-yl-pyrimidine-5-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 69122655
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Related reactions
3 records
Linked notes
Loading…