Details of the Drug

General Information of Drug (ID: DM2HYEN)

Drug Name
dimethylethylamine
Synonyms
N,N-DIMETHYLETHYLAMINE; 598-56-1; Dimethylethylamine; N,N-Dimethylethanamine; N-Ethyldimethylamine; Ethanamine, N,N-dimethyl-; Ethyldimethylamine; Ethylamine, N,N-dimethyl-; Methanamine, N-ethyl-N-methyl-; UNII-9N5384XVEM; HSDB 5712; EINECS 209-940-8; N,N-Dimethylethylamine, 99%; AI3-52225; 9N5384XVEM; DAZXVJBJRMWXJP-UHFFFAOYSA-N; C13-15-Alkyldimethylamines; Amines, C13-15-alkyldimethyl; dimethylaminoethane; dimethylethyl amine; EINECS 275-053-8; NEtMe2; NMe2Et; EtNMe2; n,n-dimethylaminoethane; PubChem10322; N,N-dimethyl-ethanamine
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL is unavailable 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 73.14
Logarithm of the Partition Coefficient (xlogp) 0.7
Rotatable Bond Count (rotbonds) 1
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 1
Chemical Identifiers
Formula
C4H11N
IUPAC Name
N,N-dimethylethanamine
Canonical SMILES
CCN(C)C
InChI
InChI=1S/C4H11N/c1-4-5(2)3/h4H2,1-3H3
InChIKey
DAZXVJBJRMWXJP-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
11723
CAS Number
598-56-1
TTD ID
D0S5DR
Drug ADMET Endpoint Profile (DAE)NEW Click to Jump to the Detailed DAE Information of This Drug

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Trace amine receptor 5 (TAAR5) TTCO25G TAAR5_HUMAN Agonist [2]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5523).
2 Trace amine-associated receptors and their ligands. Br J Pharmacol. 2006 Dec;149(8):967-78.