1-Ethylsulfonyl-piperazine

C6H14N2O2SCAS 62937-96-6178.25 g/mol

Open in Covalent MOL file
SOONNH
Secondary amineSulfonamide

Properties

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

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 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
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

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

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 Piperazine-1-sulfonic acid dimethylamide98961-97-847 % 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

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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