4-Amino-N-(2-hydroxyethyl)benzamide

C₉H₁₂N₂O₂CAS 54472-45-6180.21 g/mol

Open in Covalent MOL file

Alcohol Amide Primary amine

Properties

Molecular formula: C₉H₁₂N₂O₂
Molar mass: 180.21 g/mol
Exact mass: 180.0899 Da
logP: -0.01Crippen estimate
Polar surface area: 75.3 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

54472-45-6

SMILES

C1=CC(=CC=C1C(=O)NCCO)N

InChIKey

YECHMIOBPCMIGF-UHFFFAOYSA-N

InChI

InChI=1S/C9H12N2O2/c10-8-3-1-7(2-4-8)9(13)11-5-6-12/h1-4,12H,5-6,10H2,(H,11,13)

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Work with 4-Amino-N-(2-hydroxyethyl)benzamide

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

Similar compounds

N-(4-Aminobenzoyl)-β-alanine7377-08-465 % similar p-Aminohippuric acid61-78-959 % similar Procainamide hydrochloride614-39-153 % similar 4-Aminobenzoic acid hydrazide5351-17-753 % similar 4-Amino-N-methylbenzamide6274-22-251 % similar Sodium p-aminohippurate94-16-651 % similar N-(4-Aminophenyl)benzamide17625-83-147 % similar 4-Aminobenzoic acid150-13-043 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Ethoxybenzhydrazide21018-13-3 3-Ethoxybenzhydrazide27830-16-6 4-Amino-DL-phenylalanine2922-41-0 Ethyl 3,4-diaminobenzoate37466-90-3 1-(2-Furoyl)piperazine40172-95-0 2-(4-Methoxyphenyl)acetohydrazide57676-49-0 4-Ethoxybenzhydrazide58586-81-5 N-(3-Amino-4-methoxyphenyl)acetamide6375-47-9

Elsewhere

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