1-Methyl-2-[2-(4-tetradecyloxy-benzoylamino)-ethyl]-pyridinium; iodide

HCID 10076930
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Basic information

Standard SMILES
CCCCCCCCCCCCCCOc1ccc(C(=O)NCCc2cccc[n+]2C)cc1
InChIKey
ULZJHHBWCWUUKP-UHFFFAOYSA-O
Molecular formula
C29H45N2O2+
Average molar mass
453.7 g/mol

Names & identifiers

Preferred name
1-Methyl-2-[2-(4-tetradecyloxy-benzoylamino)-ethyl]-pyridinium; iodide
IUPAC
N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]-4-tetradecoxybenzamide

Names & synonyms

CHEMBL347349CHEMBL1184393BDBM500477751-Methyl-2-[2-(4-tetradecyloxy-benzoylamino)-ethyl]-pyridinium; iodide

Database identifiers

PubChem CID
10076930
ChEMBL
CHEMBL1184393、CHEMBL347349

Properties

Computed structural properties

XLogP
8.9
Topological polar surface area
42.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
18
Heavy atoms
33

Related reactions

1 records
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Compound notes

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