1-(diethylsulfamoylamino)-4-(methylamino)benzene

C11H19N3O2S — CID 43604119

IUPAC1-(diethylsulfamoylamino)-4-(methylamino)benzene
SMILESCCN(CC)S(=O)(=O)Nc1ccc(NC)cc1
InChIInChI=1S/C11H19N3O2S/c1-4-14(5-2)17(15,16)13-11-8-6-10(12-3)7-9-11/h6-9,12-13H,4-5H2,1-3H3
InChIKeyBZTRYKLCIQHAPR-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.73
Rot. Bonds6

About 1-(diethylsulfamoylamino)-4-(methylamino)benzene

1-(diethylsulfamoylamino)-4-(methylamino)benzene (PubChem CID 43604119) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is 1-(diethylsulfamoylamino)-4-(methylamino)benzene.

Molecular Properties

Compound Name1-(diethylsulfamoylamino)-4-(methylamino)benzene
PubChem CID43604119
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC Name1-(diethylsulfamoylamino)-4-(methylamino)benzene
SMILESCCN(CC)S(=O)(=O)Nc1ccc(NC)cc1
InChIInChI=1S/C11H19N3O2S/c1-4-14(5-2)17(15,16)13-11-8-6-10(12-3)7-9-11/h6-9,12-13H,4-5H2,1-3H3
InChIKeyBZTRYKLCIQHAPR-UHFFFAOYSA-N
XLogP1.73
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-4-(methylamino)benzenesulfonamide
CID 60979848
1-(aminomethyl)-3-(diethylsulfamoylamino)benzene
CID 28783219
N-[3-(dimethylamino)propyl]-N-ethyl-4-(methylamino)benzenesulfonamide
CID 102994804
1-cyano-3-(diethylsulfamoylamino)benzene
CID 28785061
2-(chloromethyl)-4-(diethylsulfamoylamino)-1-ethoxybenzene
CID 65032503
1-amino-2-(diethylsulfamoylamino)benzene
CID 28783371
2-methyl-N-[4-(methylamino)phenyl]propane-2-sulfonamide
CID 63689740
N-[4-(diethylamino)phenyl]methanesulfonamide;hydrochloride
CID 45050507
1,1-difluoro-N-[4-(methylamino)phenyl]methanesulfonamide
CID 43604018
N-ethyl-4-(methylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61437377
1-amino-2-(diethylsulfamoylamino)-4-methylbenzene
CID 112557490
N,N-diethyl-2,6-dimethyl-4-(methylamino)benzenesulfonamide
CID 107328499

Frequently Asked Questions

What is the IUPAC name of 1-(diethylsulfamoylamino)-4-(methylamino)benzene?
The IUPAC name of 1-(diethylsulfamoylamino)-4-(methylamino)benzene (CID 43604119) is 1-(diethylsulfamoylamino)-4-(methylamino)benzene.
What is the SMILES notation for 1-(diethylsulfamoylamino)-4-(methylamino)benzene?
The canonical SMILES for 1-(diethylsulfamoylamino)-4-(methylamino)benzene is CCN(CC)S(=O)(=O)Nc1ccc(NC)cc1.
What is the InChIKey of 1-(diethylsulfamoylamino)-4-(methylamino)benzene?
The InChIKey is BZTRYKLCIQHAPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-4-14(5-2)17(15,16)13-11-8-6-10(12-3)7-9-11/h6-9,12-13H,4-5H2,1-3H3.
What are the key properties of 1-(diethylsulfamoylamino)-4-(methylamino)benzene?
1-(diethylsulfamoylamino)-4-(methylamino)benzene has a molecular weight of 257.36 g/mol, XLogP of 1.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylsulfamoylamino)-4-(methylamino)benzene is sourced from PubChem (CID 43604119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).