Molecular Identity
Methapyrilene
N,N-dimethyl-N'-pyridin-2-yl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
PubChem CID: 4098
Methapyrilene is a member of the class of ethylenediamine derivatives that is ethylenediamine in which one of the nitrogens is substituted by two methyl groups, and the other nitrogen is substituted by a 2-pyridyl group and a (2-thienyl)methyl group. It has a role as a sedative, a H1-receptor antagonist, an anti-allergic agent and a carcinogenic agent.
2D Structure
Properties
C14H19N3S
Molecular Formula
261.39
Molecular Weight
g/mol
261.1300
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
47.6
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
4
H-Bond Acceptors
235
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2Isomeric SMILES
SMILES: CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2Synonyms(20)
methapyrilene91-80-5ThenylpyraminePyrinistolThionylanRestrylMetapyrileneSleepwellSemikonParadormaleneLullaminPyrathynPyrinistabThenyleneTenalin
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Methapyrilene
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