Phyto4Health

N-Methylaniline

Representations & DB's id

ChEBI: CHEBI:15733
ChEMBL: CHEMBL170781
PubChem: 7515
IUPAC: N-methylaniline
Standard InChI: InChI=1S/C7H9N/c1-8-7-5-3-2-4-6-7/h2-6,8H,1H3
Standard InChI Key: AFBPFSWMIHJQDM-UHFFFAOYSA-N
SMILES: CNc1ccccc1

Molecular propeties

AlogP: 1.73
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 1
Number of rings: 1
Molecular Weight: 107.07
Topological polar surface area: 12
Number of aromatic rings: 1
Fsp3: 0.143
Number of carbons: 7

Plant sources

Part of plant Plant name Ref.
PericarpiumCitrus unshiu

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.
Potency7943.3 nMThyroid stimulating hormone receptorP16473
Potency7943.3 nMThyroid stimulating hormone receptorP16473