N-(4-methoxybiphenyl-2-yl)-2,2-dimethylpropionamide

HCID 21852181

Notes Reactions

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Basic information

Standard SMILES: COc1ccc(-c2ccccc2)c(NC(=O)C(C)(C)C)c1
InChIKey: AVGYQBVDOGFRKC-UHFFFAOYSA-N
Molecular formula: C18H21NO2
Average molar mass: 283.4 g/mol
Monoisotopic mass: 283.15722891

Names & identifiers

Preferred name: N-(4-methoxybiphenyl-2-yl)-2,2-dimethylpropionamide
IUPAC: N-(5-methoxy-2-phenylphenyl)-2,2-dimethylpropanamide

Names & synonyms

SCHEMBL8471964AVGYQBVDOGFRKC-UHFFFAOYSA-NN-(4-methoxybiphenyl-2-yl)-2,2-dimethylpropionamideN-(4-Methoxy-[1,1'-biphenyl]-2-yl)-2,2-dimethylpropanamide

Database identifiers

PubChem CID: 21852181

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 38.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 21
Formal charge: 0
Complexity: 342

Related reactions

4 records

New reaction record

HRID 617407As productuspto-grants-1999_09

HRID 617408As reactantuspto-grants-1999_09

HRID 1122589As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 2154168As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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