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N-Cyclopentyl-N-(2,2-dimethoxyethyl)-3-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanamide

HCID 59290486
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCn1cc(-c2cccc(CCOCCC(=O)N(CC(OC)OC)C3CCCC3)c2)cn1
InChIKey
WWUQISZZVPZCMB-UHFFFAOYSA-N
Molecular formula
C25H37N3O4
Average molar mass
443.6 g/mol

Names & identifiers

Preferred name
N-Cyclopentyl-N-(2,2-dimethoxyethyl)-3-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanamide
IUPAC
N-cyclopentyl-N-(2,2-dimethoxyethyl)-3-[2-[3-(1-ethylpyrazol-4-yl)phenyl]ethoxy]propanamide

Names & synonyms

SCHEMBL1559951WWUQISZZVPZCMB-UHFFFAOYSA-NN-Cyclopentyl-N-(2,2-dimethoxyethyl)-3-(3-(1-ethyl-1H-pyrazol-4-yl)phenethoxy)propanamide

Database identifiers

PubChem CID
59290486

Properties

Computed structural propertiesFilling in

XLogP
2.8
Topological polar surface area
65.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
13
Heavy atoms
32
Formal charge
0
Complexity
539

Related reactions

2 records
New reaction record
HRID 102601 reaction equation
HRID 102601As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 909939 reaction equation
HRID 909939As productuspto-grants-2011_09

Compound notes

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