Basic information
- Standard SMILES
CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1- InChIKey
BGUQJVYGWPKAKN-UHFFFAOYSA-N- Molecular formula
- C12H13N3O3
- Average molar mass
- 247.25 g/mol
Names & identifiers
- Preferred name
- 5-Nitro-1H-indole-2-carboxylic acid propylamide
- IUPAC
- 5-nitro-N-propyl-1H-indole-2-carboxamide
Names & synonyms
SCHEMBL1415543BGUQJVYGWPKAKN-UHFFFAOYSA-N5-Nitro-1H-indole-2-carboxylic acid propylamide
Database identifiers
- PubChem CID
- 67023975
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 329
Related reactions
4 records
Compound notes
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