N-(4-Aminophenyl)-N,4-dimethyl-1-piperazineacetamide

C₁₄H₂₂N₄OCAS 262368-30-9262.36 g/mol

Open in Covalent MOL file

Amide Primary amine Tertiary amine

Properties

Molecular formula: C₁₄H₂₂N₄O
Molar mass: 262.36 g/mol
Exact mass: 262.1794 Da
logP: 0.48Crippen estimate
Polar surface area: 52.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

262368-30-9

SMILES

CN1CCN(CC(=O)N(C)c2ccc(N)cc2)CC1

InChIKey

LBWNQLVDYPNHAV-UHFFFAOYSA-N

InChI

InChI=1S/C14H22N4O/c1-16-7-9-18(10-8-16)11-14(19)17(2)13-5-3-12(15)4-6-13/h3-6H,7-11,15H2,1-2H3

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

Names and synonyms

3 names

1-Piperazineacetamide, N-(4-aminophenyl)-N,4-dimethyl-
N-[[(4-Methylpiperazin-1-yl)methyl]carbonyl]-N-methyl-p-phenylenediamine
N-(4-Aminophenyl)-N-methyl-2-(4-methylpiperazin-1-yl)acetamide

Work with N-(4-Aminophenyl)-N,4-dimethyl-1-piperazineacetamide

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-Aminophenyl)-N-methylacetamide119-63-153 % similar 4-(4-Methylpiperazin-1-yl)aniline16153-81-451 % similar 4-(4-Methylpiperazine-1-sulfonyl)aniline21623-68-741 % similar 4-(4-Aminophenyl)morpholin-3-one438056-69-040 % similar 2-Chloro-N-methyl-N-phenylacetamide2620-05-540 % similar Nintedanib656247-17-539 % similar Nintedanib928326-83-439 % similar 4-(4-Ethyl-1-piperazinyl)benzenamine115619-01-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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