Basic information
- CAS
3910-25-6- Standard SMILES
CCCc1nc(N)nc(OC)n1- InChIKey
SWXAQMFYWSHBDI-UHFFFAOYSA-N- Molecular formula
- C7H12N4O
- Average molar mass
- 168.2 g/mol
- Monoisotopic mass
- 168.10111102
Names & identifiers
- Preferred name
- 1,3,5-Triazin-2-amine, 4-methoxy-6-propyl-
- IUPAC
- 4-methoxy-6-propyl-1,3,5-triazin-2-amine
Names & synonyms
4-Methoxy-6-propyl-1,3,5-triazin-2-amine1,3,5-Triazin-2-amine, 4-methoxy-6-propyl-3910-25-6BRN 0513252SCHEMBL10880722DTXSID90192347
Database identifiers
- CAS
3910-25-6- PubChem CID
- 199263
- DTXSID
DTXSID90192347
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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