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4-amino-3-ethoxy-N-(1-methylpyrrolidin-3-yl)benzamide

HCID 68844872
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCOc1cc(C(=O)NC2CCN(C)C2)ccc1N
InChIKey
REQNUDYDUFCRPT-UHFFFAOYSA-N
Molecular formula
C14H21N3O2
Average molar mass
263.34 g/mol
Monoisotopic mass
263.16337692

Names & identifiers

Preferred name
4-amino-3-ethoxy-N-(1-methylpyrrolidin-3-yl)benzamide
IUPAC
4-amino-3-ethoxy-N-(1-methylpyrrolidin-3-yl)benzamide

Names & synonyms

SCHEMBL3933554

Database identifiers

PubChem CID
68844872

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
67.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
311

Related reactions

1 records
New reaction record
HRID 1207943 reaction equation
HRID 1207943As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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