2-(Tert-butylamino)pyridine-3-carbonitrile
Basic information
- CAS
52583-88-7- Standard SMILES
CC(C)(C)Nc1ncccc1C#N- InChIKey
SLDQMMQBPHHSBQ-UHFFFAOYSA-N- Molecular formula
- C10H13N3
- Average molar mass
- 175.23 g/mol
- Monoisotopic mass
- 175.11094743
Names & identifiers
- Preferred name
- 2-(Tert-butylamino)pyridine-3-carbonitrile
- IUPAC
- 2-(tert-butylamino)pyridine-3-carbonitrile
Names & synonyms
52583-88-72-(tert-butylamino)pyridine-3-carbonitrile2-[(1,1-Dimethylethyl)amino]-3-pyridinecarbonitrileSCHEMBL14184983DTXSID201223071AKOS000177068
Database identifiers
- CAS
52583-88-7- PubChem CID
- 10352201
- DTXSID
DTXSID201223071
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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