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2-(3-Amino-4-benzyloxyphenyl)acetic acid dipropylamide

HCID 13629299
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Basic information

Standard SMILES
CCCN(CCC)C(=O)Cc1ccc(OCc2ccccc2)c(N)c1
InChIKey
FURLFVAAQZUNCE-UHFFFAOYSA-N
Molecular formula
C21H28N2O2
Average molar mass
340.5 g/mol

Names & identifiers

Preferred name
2-(3-Amino-4-benzyloxyphenyl)acetic acid dipropylamide
IUPAC
2-(3-amino-4-phenylmethoxyphenyl)-N,N-dipropylacetamide

Names & synonyms

SCHEMBL10410151FURLFVAAQZUNCE-UHFFFAOYSA-N2-(3-amino-4-benzyloxyphenyl)acetic acid dipropylamide

Database identifiers

PubChem CID
13629299

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
55.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
25
Formal charge
0
Complexity
376

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Related reactions

6 records
New reaction record
HRID 92393 reaction equation
HRID 92393As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 819414 reaction equation
HRID 819414As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1032509 reaction equation
HRID 1032509As productuspto-grants-1990_09
HRID 1032510 reaction equation
HRID 1032510As reactantuspto-grants-1990_09
HRID 1032521 reaction equation
HRID 1032521As reactantuspto-grants-1990_09
HRID 1555915 reaction equation
HRID 1555915As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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