1-Hexanoic acid-[1-(3-methoxyphenyl)-2-(1-methyl-2-pyrrolidinyl)-ethyl]-ester

HCID 20344129
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Basic information

Standard SMILES
CCCCCC(=O)OC(CC1CCCN1C)c1cccc(OC)c1
InChIKey
IHMYKCYVPGJQDL-UHFFFAOYSA-N
Molecular formula
C20H31NO3
Average molar mass
333.5 g/mol

Names & identifiers

Preferred name
1-Hexanoic acid-[1-(3-methoxyphenyl)-2-(1-methyl-2-pyrrolidinyl)-ethyl]-ester
IUPAC
[1-(3-methoxyphenyl)-2-(1-methylpyrrolidin-2-yl)ethyl] hexanoate

Names & synonyms

SCHEMBL11463126IHMYKCYVPGJQDL-UHFFFAOYSA-N1-hexanoic acid-[1-(3-methoxyphenyl)-2-(1-methyl-2-pyrrolidinyl)-ethyl]-ester

Database identifiers

PubChem CID
20344129

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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