Basic information
- CAS
262607-97-6- Standard SMILES
Cc1c(C#N)c(N)n(CC2CC2)c1C- InChIKey
OICBQNWDYZJYGN-UHFFFAOYSA-N- Molecular formula
- C11H15N3
- Average molar mass
- 189.26 g/mol
- Monoisotopic mass
- 189.12659749
Names & identifiers
- Preferred name
- 2-amino-1-(cyclopropylmethyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
- IUPAC
- 2-amino-1-(cyclopropylmethyl)-4,5-dimethylpyrrole-3-carbonitrile
Names & synonyms
Oprea1_299912262607-97-6DTXSID806358992-amino-1-(cyclopropylmethyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrileAKOS009336259
Database identifiers
- CAS
262607-97-6- PubChem CID
- 23823391
- DTXSID
DTXSID80635899
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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