1-(4-(4-Hydroxyphenyl)piperazin-1-yl)ethanone

C₁₂H₁₆N₂O₂CAS 67914-60-7220.27 g/mol

Open in Covalent MOL file

Amide Phenol Tertiary amine

Properties

Molecular formula: C₁₂H₁₆N₂O₂
Molar mass: 220.27 g/mol
Exact mass: 220.1212 Da
Melting point: 180 °C
logP: 1.06Crippen estimate
Polar surface area: 43.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation94.1% of notifiers
H319 Causes serious eye irritation94.1% of notifiers
H335 May cause respiratory irritation92.2% of notifiers

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

67914-60-7

SMILES

CC(=O)N1CCN(c2ccc(O)cc2)CC1

InChIKey

AGVNLFCRZULMKK-UHFFFAOYSA-N

InChI

InChI=1S/C12H16N2O2/c1-10(15)13-6-8-14(9-7-13)11-2-4-12(16)5-3-11/h2-5,16H,6-9H2,1H3

Weigh it out

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

Names and synonyms

10 names

1-Acetyl-4-(4-hydroxyphenyl)piperazine
Ethanone, 1-[4-(4-hydroxyphenyl)-1-piperazinyl]-
Piperazine, 1-acetyl-4-(4-hydroxyphenyl)-
1-[4-(4-Hydroxyphenyl)-1-piperazinyl]ethanone
T 1141
1-Acetyl-4-(p-hydroxyphenyl)piperazine
4-(4-Acetylpiperazino)phenol
1-[4-(4-Hydroxyphenyl)piperazin-1-yl]ethanone
4-(4-Acetylpiperazin-1-yl)phenol
1-[4-(4-Hydroxyphenyl)piperazin-1-yl]ethan-1-one

Work with 1-(4-(4-Hydroxyphenyl)piperazin-1-yl)ethanone

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

1-Acetyl-4-(3-hydroxyphenyl)piperazine67915-02-068 % similar p-(1-Piperazinyl)phenol56621-48-851 % similar 4-(4-Acetyl-1-piperazinyl)-2-(methyloxy)aniline1021426-42-551 % similar p-(4-Isopropyl-1-piperazinyl)phenol67914-97-050 % similar 4-[4-(4-Aminophenyl)-1-piperazinyl]phenol74853-08-050 % similar 4-[4-(4-Nitrophenyl)-1-piperazinyl]phenol112559-81-646 % similar Phenyl N-[4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl]carbamate184177-81-944 % similar 1-Acetylpiperazine13889-98-043 % similar

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

Same formula

(S)-1-Cbz-3-aminopyrrolidine122536-72-5 Phenylmethyl (3R)-3-amino-1-pyrrolidinecarboxylate122536-73-6 3-Amino-1-benzylpyrrolidine-3-carboxylic acid145602-87-5 (S)-3-N-Cbz-aminopyrrolidine176970-12-0 Phenylmethyl 3-amino-1-pyrrolidinecarboxylate185057-50-5 3-(4-Methyl-1-piperazinyl)benzoic acid215309-01-6 Benzyl piperazine-1-carboxylate31166-44-6 1-Piperonylpiperazine32231-06-4

Elsewhere

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