Basic information
- Standard SMILES
CC(CCCc1ccccc1)n1nnc(C(N)=O)c1N- InChIKey
RTTPPDCDRZDYQI-UHFFFAOYSA-N- Molecular formula
- C14H19N5O
- Average molar mass
- 273.33 g/mol
Names & identifiers
- Preferred name
- 5-Amino-1-(1-methyl-4-phenyl-butyl)-1H-[1,2,3]triazole-4-carboxamide
- IUPAC
- 5-amino-1-(5-phenylpentan-2-yl)triazole-4-carboxamide
Names & synonyms
SCHEMBL7361207RTTPPDCDRZDYQI-UHFFFAOYSA-N5-Amino-1-(1-methyl-4-phenyl-butyl)-1H-[1,2,3]triazole-4-carboxamide
Database identifiers
- PubChem CID
- 11149992
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 319
Related reactions
13 records
Compound notes
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