Indole-3-carboxaldehyde, 5-dimethylamino-
Basic information
- CAS
6843-27-2- Standard SMILES
CN(C)c1ccc2[nH]cc(C=O)c2c1- InChIKey
ZBXFRJNUAWOOCU-UHFFFAOYSA-N- Molecular formula
- C11H12N2O
- Average molar mass
- 188.23 g/mol
- Monoisotopic mass
- 188.09496301
Names & identifiers
- Preferred name
- Indole-3-carboxaldehyde, 5-dimethylamino-
- IUPAC
- 5-(dimethylamino)-1H-indole-3-carbaldehyde
Names & synonyms
3-Formyl-5-dimethylamino indoleBRN 0389928INDOLE-3-CARBOXALDEHYDE, 5-DIMETHYLAMINO-6843-27-25-Dimethylaminoindole-3-carboxaldehydeDTXSID902185515-22-13-00021 (Beilstein Handbook Reference)RefChem:349310DTXCID401410425-(dimethylamino)-1H-indole-3-carbaldehydeSCHEMBL25253642
Database identifiers
- CAS
6843-27-2- PubChem CID
- 23277
- DTXSID
DTXSID90218551
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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