4-(2-Methylbenzoylamino)-2-methylbenzoic acid

C₁₆H₁₅NO₃CAS 317374-08-6269.30 g/mol

Open in Covalent MOL file

Alcohol Amide Carboxylic Acid

Properties

Molecular formula: C₁₆H₁₅NO₃
Molar mass: 269.30 g/mol
Exact mass: 269.1052 Da
logP: 3.25Crippen estimate
Polar surface area: 66.4 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Identifiers

CAS number

317374-08-6

SMILES

Cc1cc(NC(=O)c2ccccc2C)ccc1C(=O)O

InChIKey

KJGSVQLCVULXJU-UHFFFAOYSA-N

InChI

InChI=1S/C16H15NO3/c1-10-5-3-4-6-13(10)15(18)17-12-7-8-14(16(19)20)11(2)9-12/h3-9H,1-2H3,(H,17,18)(H,19,20)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names

Benzoic acid, 2-methyl-4-[(2-methylbenzoyl)amino]-
2-Methyl-4-[(2-methylbenzoyl)amino]benzoic acid
2-Methyl-4-(2-methylbenzamido)benzoic acid
2-Methyl-4-(2-methylbenzamido)benzoicacid

Work with 4-(2-Methylbenzoylamino)-2-methylbenzoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

L-4-Benzoylphenylalanine104504-45-2 (-)-N-(α-Methylbenzyl)phthalic acid monoamide21752-36-3 Benzoyl-L-phenylalanine2566-22-5 N-Benzoyl-dl-phenylalanine2901-76-0

Elsewhere

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