Esketamine
(2S)-2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one
Molecular Identity
Esketamine
(2S)-2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one
PubChem CID: 182137
Esketamine is the S- (more active) enantiomer of ketamine. It has a role as an analgesic, an intravenous anaesthetic and a NMDA receptor antagonist. It is an enantiomer of a (R)-ketamine.
2D Structure
Properties
C13H16ClNO
Molecular Formula
237.72
Molecular Weight
g/mol
237.0920
Exact Mass
Da
2.2
XLogP
Drug-like (Lipinski: < 5)
29.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
269
Complexity
SMILES
Canonical SMILES
SMILES: CNC1(CCCCC1=O)C2=CC=CC=C2ClIsomeric SMILES
SMILES: CN[C@@]1(CCCCC1=O)C2=CC=CC=C2ClSynonyms(20)
Esketaminel-Ketamine(S)-Ketamine(-)-KetamineS-Ketamine33643-46-8(S)-(-)-KetamineKetavedKeta-sKetamine, s-Ketamine, (s)-S-(-)-Ketamineesketamina(S)-2-(o-chlorophenyl)-2-(methylamino)cyclohexanoneKataved
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Esketamine
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