Basic information
- Standard SMILES
CC(=O)Nc1nc(NCCCOc2cccc(CN(C)C)c2)n(C)n1- InChIKey
RIUBEZMYGAFFDZ-UHFFFAOYSA-N- Molecular formula
- C17H26N6O2
- Average molar mass
- 346.4 g/mol
Names & identifiers
- Preferred name
- N-[5-[[3-[3-[(Dimethylamino)methyl]phenoxy]propyl]amino]-1-methyl-1H-1,2,4-triazol-3-yl]acetamide
- IUPAC
- N-[5-[3-[3-[(dimethylamino)methyl]phenoxy]propylamino]-1-methyl-1,2,4-triazol-3-yl]acetamide
Names & synonyms
SCHEMBL10664068RIUBEZMYGAFFDZ-UHFFFAOYSA-NN-[5-[[3-[3-[(dimethylamino)methyl]phenoxy]propyl]-amino]-1-methyl-1H-1,2,4-triazol-3-yl]acetamideN-[5-[[3-[3-[(Dimethylamino)methyl]phenoxy]propyl]amino]-1-methyl-1H-1,2,4-triazol-3-yl]acetamide
Database identifiers
- PubChem CID
- 21297601
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 409
Related reactions
8 records
Compound notes
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