Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
3-(4-aminophenyl)-N-methyl-N-[(1-methylindol-2-yl)methyl]prop-2-enamide
HCID
66780543
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CN(Cc1cc2ccccc2n1C)C(=O)C=Cc1ccc(N)cc1
InChIKey
JGTLZJKIHHZHOX-UHFFFAOYSA-N
Molecular formula
C20H21N3O
Average molar mass
319.4 g/mol
Monoisotopic mass
319.1684623
Names & identifiers
Preferred name
3-(4-aminophenyl)-N-methyl-N-[(1-methylindol-2-yl)methyl]prop-2-enamide
IUPAC
3-(4-aminophenyl)-N-methyl-N-[(1-methylindol-2-yl)methyl]prop-2-enamide
Names & synonyms
SCHEMBL725472
Database identifiers
PubChem CID
66780543
Properties
Computed structural properties
XLogP
2.7
Topological polar surface area
51.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
24
Formal charge
0
Complexity
456
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
959081
As product
Validation data from https://doi.org/10.1039/C8SC04228D
Compound notes
Loading…