[4-Methyl-6-(2-oxopropyl)pyrimidin-2-yl]cyanamide
Basic information
- CAS
55558-87-7- Standard SMILES
CC(=O)Cc1cc(C)nc(NC#N)n1- InChIKey
UKTADWFKOMTWRG-UHFFFAOYSA-N- Molecular formula
- C9H10N4O
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.08546096
Names & identifiers
- Preferred name
- [4-Methyl-6-(2-oxopropyl)pyrimidin-2-yl]cyanamide
- IUPAC
- [4-methyl-6-(2-oxopropyl)pyrimidin-2-yl]cyanamide
Names & synonyms
55558-87-7[4-methyl-6-(2-oxopropyl)pyrimidin-2-yl]cyanamideNSC232486DTXSID20310835NSC-232486
Database identifiers
- CAS
55558-87-7- PubChem CID
- 314568
- DTXSID
DTXSID20310835
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 78.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 257
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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