potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride

C19H37KN4O4S2 — CID 173197580

IUPACpotassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride
SMILESCCCCC(CC)CNS(=O)(=O)C(C#N)(C#N)S(=O)(=O)NCC(CC)CCCC.[H-].[K+]
InChIInChI=1S/C19H36N4O4S2.K.H/c1-5-9-11-17(7-3)13-22-28(24,25)19(15-20,16-21)29(26,27)23-14-18(8-4)12-10-6-2;;/h17-18,22-23H,5-14H2,1-4H3;;/q;+1;-1
InChIKeyKEHRKMDYSFITGJ-UHFFFAOYSA-N
MW488.76 g/mol
LogP0.12
Rot. Bonds16

About potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride

potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride (PubChem CID 173197580) has the molecular formula C19H37KN4O4S2 and a molecular weight of 488.76 g/mol. Its IUPAC name is potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride.

Molecular Properties

Compound Namepotassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride
PubChem CID173197580
Molecular FormulaC19H37KN4O4S2
Molecular Weight488.76 g/mol
Exact Mass488.19
IUPAC Namepotassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride
SMILESCCCCC(CC)CNS(=O)(=O)C(C#N)(C#N)S(=O)(=O)NCC(CC)CCCC.[H-].[K+]
InChIInChI=1S/C19H36N4O4S2.K.H/c1-5-9-11-17(7-3)13-22-28(24,25)19(15-20,16-21)29(26,27)23-14-18(8-4)12-10-6-2;;/h17-18,22-23H,5-14H2,1-4H3;;/q;+1;-1
InChIKeyKEHRKMDYSFITGJ-UHFFFAOYSA-N
XLogP0.12
TPSA139.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.76
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-2-ethylhexyl]methanesulfonamide;molecular hydrogen
CID 145277328
N-(2-ethylhexyl)dodecane-1-sulfonamide
CID 20789895
3-ethyl-1-(3-ethylheptylsulfonyl)heptane
CID 57030599
4,5-dicyano-1-N,2-N-bis(2-ethylhexyl)imidazole-1,2-disulfonamide
CID 22600926
N-(2-ethylhexyl)-2,4,6-trimethylbenzenesulfonamide
CID 5144200
2-(2-ethylhexyl)-1,1-dimethylhydrazine
CID 83014664
(3S)-3-(ethenylsulfonylmethyl)heptane
CID 7046547
N-(3,3-dimethylbutan-2-yl)-2-ethylhexan-1-amine
CID 104828083
N,2-diethylhexan-1-amine
CID 14272988
magnesium;2-ethyl-N-(2-ethylhexyl)hexan-1-amine;dichloride
CID 174776336
N-(2-ethylhexyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 19681666
2-ethyl-N-(2,3,3-trimethylbutyl)hexan-1-amine
CID 83142777

Frequently Asked Questions

What is the IUPAC name of potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride?
The IUPAC name of potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride (CID 173197580) is potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride.
What is the SMILES notation for potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride?
The canonical SMILES for potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride is CCCCC(CC)CNS(=O)(=O)C(C#N)(C#N)S(=O)(=O)NCC(CC)CCCC.[H-].[K+].
What is the InChIKey of potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride?
The InChIKey is KEHRKMDYSFITGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N4O4S2.K.H/c1-5-9-11-17(7-3)13-22-28(24,25)19(15-20,16-21)29(26,27)23-14-18(8-4)12-10-6-2;;/h17-18,22-23H,5-14H2,1-4H3;;/q;+1;-1.
What are the key properties of potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride?
potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride has a molecular weight of 488.76 g/mol, XLogP of 0.12, 16 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1,1-dicyano-N,N'-bis(2-ethylhexyl)methanedisulfonamide;hydride is sourced from PubChem (CID 173197580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).