Basic information
- Standard SMILES
CC(Nc1ncc(C#N)c2[nH]c3ccc(F)cc3c12)C1CC1- InChIKey
IZCBJYDPUHLWQX-UHFFFAOYSA-N- Molecular formula
- C17H15FN4
- Average molar mass
- 294.33 g/mol
Names & identifiers
- Preferred name
- 1-[(1-Cyclopropylethyl)amino]-8-fluoro-5H-pyrido[4,3-b]indole-4-carbonitrile
- IUPAC
- 1-(1-cyclopropylethylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carbonitrile
Names & synonyms
SCHEMBL3507052IZCBJYDPUHLWQX-UHFFFAOYSA-N1-[(1-Cyclopropylethyl)amino]-8-fluoro-5H-pyrido[4,3-b]indole-4-carbonitrile
Database identifiers
- PubChem CID
- 59543162
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 471
Related reactions
4 records
Compound notes
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