Basic information
- Standard SMILES
COc1cc(OC)nc(N(C)c2ccc(I)cc2)n1- InChIKey
DBHXXVBPYYJHEJ-UHFFFAOYSA-N- Molecular formula
- C13H14IN3O2
- Average molar mass
- 371.17 g/mol
- Monoisotopic mass
- 371.01307
Names & identifiers
- Preferred name
- N-(4-iodophenyl)-4,6-dimethoxy-N-methylpyrimidin-2-amine
- IUPAC
- N-(4-iodophenyl)-4,6-dimethoxy-N-methylpyrimidin-2-amine
Names & synonyms
SCHEMBL1120965DBHXXVBPYYJHEJ-UHFFFAOYSA-NN-(4-iodophenyl)-4,6-dimethoxy-N-methylpyrimidin-2-amine
Database identifiers
- PubChem CID
- 57762579
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 47.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 263
Related reactions
7 records
Compound notes
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