1-Ethylsulfonyl-piperazine

C₆H₁₄N₂O₂SCAS 62937-96-6178.25 g/mol

Open in Covalent MOL file

Secondary amine Sulfonamide

Properties

Molecular formula: C₆H₁₄N₂O₂S
Molar mass: 178.25 g/mol
Exact mass: 178.0776 Da
logP: -0.76Crippen estimate
Polar surface area: 49.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

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

62937-96-6

SMILES

CCS(=O)(=O)N1CCNCC1

InChIKey

BIYGAOBOLDXNHM-UHFFFAOYSA-N

InChI

InChI=1S/C6H14N2O2S/c1-2-11(9,10)8-5-3-7-4-6-8/h7H,2-6H2,1H3

Weigh it out

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Names and synonyms

1 names

1-(Ethanesulfonyl)piperazine

Work with 1-Ethylsulfonyl-piperazine

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-Methanesulfonyl-piperazine55276-43-250 % similar 1-(1-Piperidinylsulfonyl)piperazine500587-48-443 % similar 2-(1-(Ethylsulfonyl)azetidin-3-ylidene)acetonitrile1187595-85-238 % similar 1-(4-Chloro-benzenesulfonyl)-piperazine16017-53-138 % similar 1-[(4-Methylphenyl)sulfonyl]piperazine27106-51-038 % similar 1-Benzenesulfonyl-piperazine14172-55-537 % similar 1-Ethylpiperazine5308-25-836 % similar 1-Propylpiperazine21867-64-134 % similar

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

Same formula

1-(Methanesulfonyl)piperidin-4-amine402927-97-3 4-(2-Aminoethyl)thiomorpholine 1,1-dioxide89937-52-0

Elsewhere

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