N-Benzyl-2-(4-fluoro-2-methyl-phenylamino)acetamide

HCID 17954343

Notes Reactions

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Basic information

Standard SMILES: Cc1cc(F)ccc1NCC(=O)NCc1ccccc1
InChIKey: FSYOQIKZQNECHO-UHFFFAOYSA-N
Molecular formula: C16H17FN2O
Average molar mass: 272.32 g/mol

Names & identifiers

Preferred name: N-Benzyl-2-(4-fluoro-2-methyl-phenylamino)acetamide
IUPAC: N-benzyl-2-(4-fluoro-2-methylanilino)acetamide

Names & synonyms

SCHEMBL3645383FSYOQIKZQNECHO-UHFFFAOYSA-NAKOS008564138N-benzyl-2-(4-fluoro-2-methyl-phenylamino)-acetamideN-Benzyl-2-(4-fluoro-2-methyl-phenylamino)acetamide

Database identifiers

PubChem CID: 17954343

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 41.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 305

Related reactions

6 records

New reaction record

HRID 211702As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 682743As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 828602As productTest data from https://doi.org/10.1039/C8SC04228D

HRID 1350093As productuspto-grants-2007_05

HRID 2065753As productuspto-grants-2012_10

HRID 2065754As reactantuspto-grants-2012_10

Compound notes

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