Basic information
- Standard SMILES
Cc1cc(C)c(-c2cn(C)c(C#N)c2N)c(C)c1- InChIKey
HYUVUTAKNUOJBX-UHFFFAOYSA-N- Molecular formula
- C15H17N3
- Average molar mass
- 239.32 g/mol
Names & identifiers
- Preferred name
- 3-amino-1-methyl-4-(2,4,6-trimethylphenyl)-1H-pyrrole-2-carbonitrile
- IUPAC
- 3-amino-1-methyl-4-(2,4,6-trimethylphenyl)pyrrole-2-carbonitrile
Names & synonyms
SCHEMBL5787544HYUVUTAKNUOJBX-UHFFFAOYSA-N3-amino-1-methyl-4-(2,4,6-trimethylphenyl)-1H-pyrrole-2-carbonitrile3-amino-1-methyl-4-(2,4,6-trimethylphenyl)-1H-pyrrole-2carbonitrile
Database identifiers
- PubChem CID
- 22474443
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 333
Related reactions
2 records
Compound notes
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