7-(aminocarbonyl)-1H-indole-4-carboxylic acid
Basic information
- Standard SMILES
NC(=O)c1ccc(C(=O)O)c2cc[nH]c12- InChIKey
LDNDDJQPPUFINN-UHFFFAOYSA-N- Molecular formula
- C10H8N2O3
- Average molar mass
- 204.18 g/mol
Names & identifiers
- Preferred name
- 7-(aminocarbonyl)-1H-indole-4-carboxylic acid
- IUPAC
- 7-carbamoyl-1H-indole-4-carboxylic acid
Names & synonyms
7-(aminocarbonyl)-1H-indole-4-carboxylic acid1149384-12-21h-indole-4-carboxylic acid,7-(aminocarbonyl)-SCHEMBL2424952LDNDDJQPPUFINN-UHFFFAOYSA-NDB-350670
Database identifiers
- PubChem CID
- 57748333
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 292
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Related reactions
2 records
Compound notes
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