Basic information
- Standard SMILES
Cc1cc(C#N)ncc1CC(C)C- InChIKey
XBBVEYUQVLTAFD-UHFFFAOYSA-N- Molecular formula
- C11H14N2
- Average molar mass
- 174.24 g/mol
Names & identifiers
- Preferred name
- 5-Isobutyl-4-methyl-pyridine-2-carbonitrile
- IUPAC
- 4-methyl-5-(2-methylpropyl)pyridine-2-carbonitrile
Names & synonyms
5-isobutyl-4-methyl-pyridine-2-carbonitrile1186605-92-4SCHEMBL3400777XBBVEYUQVLTAFD-UHFFFAOYSA-NDB-368737
Database identifiers
- PubChem CID
- 68628343
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 201
Related reactions
2 records
Compound notes
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