[4-Methyl-6-(2-phenyliminopropyl)pyrimidin-2-yl]cyanamide
Basic information
- CAS
55558-92-4- Standard SMILES
CC(Cc1cc(C)nc(NC#N)n1)=Nc1ccccc1- InChIKey
FQXHGSLKYIULPW-UHFFFAOYSA-N- Molecular formula
- C15H15N5
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.1327455
Names & identifiers
- Preferred name
- [4-Methyl-6-(2-phenyliminopropyl)pyrimidin-2-yl]cyanamide
- IUPAC
- [4-methyl-6-(2-phenyliminopropyl)pyrimidin-2-yl]cyanamide
Names & synonyms
NSC23248955558-92-4DTXSID80310836NSC-232489{4-Methyl-6-[(2E)-2-(phenylimino)propyl]pyrimidin-2-yl}cyanamide
Database identifiers
- CAS
55558-92-4- PubChem CID
- 314571
- DTXSID
DTXSID80310836
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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