chempirical

4-(Ethylsulfonyl)-N1,N1-dipropyl-1,3-benzenediamine

C14H24N2O2SCAS 1219957-21-7284.42 g/mol

Open in Covalent MOL file
NSOONH2
Primary amineSulfoneTertiary amine

Properties

Molecular formula
C14H24N2O2S
Molar mass
284.42 g/mol
Exact mass
284.1558 Da
logP
2.69Crippen estimate
Polar surface area
63.4 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
7

Identifiers

CAS number
1219957-21-7
SMILES
CCCN(CCC)C1=CC(=C(C=C1)S(=O)(=O)CC)N
InChIKey
MLVYDGGDIFTSAW-UHFFFAOYSA-N
InChI
InChI=1S/C14H24N2O2S/c1-4-9-16(10-5-2)12-7-8-14(13(15)11-12)19(17,18)6-3/h7-8,11H,4-6,9-10,15H2,1-3H3

Weigh it out

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

Work with 4-(Ethylsulfonyl)-N1,N1-dipropyl-1,3-benzenediamine

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

2-(Ethylsulfonyl)-5-(1-pyrrolidinyl)aniline1219972-54-982 % similar 2-(Ethylsulfonyl)-5-(1-piperidinyl)aniline1220021-52-280 % similar 2-(Ethylsulfonyl)-5-(4-morpholinyl)benzenamine1220034-99-076 % similar N1,N1-Diethyl-4-(ethylsulfonyl)-1,3-benzenediamine1220028-93-275 % similar 2-{4-[3-Amino-4-(ethylsulfonyl)phenyl]-1-piperazinyl}-1-ethanol1220039-23-570 % similar 4-(Methylsulfonyl)-N1,N1-dipropyl-1,3-benzenediamine1220033-60-269 % similar N1-Butyl-4-(ethylsulfonyl)-N1-methyl-1,3-benzenediamine1219957-17-169 % similar 4-(Ethylsulfonyl)-N1,N1-dimethyl-1,3-benzenediamine1220028-78-368 % similar

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

Elsewhere

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