Molecular Identity
Glycopyrronium
(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate
PubChem CID: 3494
2-cyclopentyl-2-hydroxy-2-phenylacetic acid (1,1-dimethyl-3-pyrrolidin-1-iumyl) ester is a member of benzenes.
2D Structure
Properties
C19H28NO3+
Molecular Formula
318.40
Molecular Weight
g/mol
318.2069
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
46.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
424
Complexity
SMILES
Canonical SMILES
SMILES: C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)CIsomeric SMILES
SMILES: C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)CSynonyms(20)
GlycopyrroniumGlycopyrrolate cationGlycopyrrolate ionGlycopyrronium ionGlycopyrronium cationGlycopyrronium, erythro-740028-90-4Pyrrolidinium, 3-((cyclopentylhydroxyphenylacetyl)oxy)-1,1-dimethyl-RefChem:922362Pyrrolidinium, 3-[(cyclopentylhydroxyphenylacetyl)oxy]-1,1-dimethyl-A14FB57V1D13283-82-4Robinal3-(2-Cyclopentyl-2-hydroxy-2-phenylacetoxy)-1,1-dimethylpyrrolidin-1-iumNCGC00179456-02
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Glycopyrronium
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