2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide

C11H15Br2N3O3S — CID 43577463

IUPAC2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide
SMILESCC(NS(=O)(=O)c1c(N)cc(Br)cc1Br)C(=O)N(C)C
InChIInChI=1S/C11H15Br2N3O3S/c1-6(11(17)16(2)3)15-20(18,19)10-8(13)4-7(12)5-9(10)14/h4-6,15H,14H2,1-3H3
InChIKeyZRTAFMLPLLJHNG-UHFFFAOYSA-N
MW429.13 g/mol
LogP1.55
Rot. Bonds4

About 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide

2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide (PubChem CID 43577463) has the molecular formula C11H15Br2N3O3S and a molecular weight of 429.13 g/mol. Its IUPAC name is 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide
PubChem CID43577463
Molecular FormulaC11H15Br2N3O3S
Molecular Weight429.13 g/mol
Exact Mass426.92
IUPAC Name2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide
SMILESCC(NS(=O)(=O)c1c(N)cc(Br)cc1Br)C(=O)N(C)C
InChIInChI=1S/C11H15Br2N3O3S/c1-6(11(17)16(2)3)15-20(18,19)10-8(13)4-7(12)5-9(10)14/h4-6,15H,14H2,1-3H3
InChIKeyZRTAFMLPLLJHNG-UHFFFAOYSA-N
XLogP1.55
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.13
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-4,6-dibromo-N-[(2R)-1-hydroxypropan-2-yl]benzenesulfonamide
CID 93081298
2-[(2,4-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 47304785
2-amino-4,6-dibromo-N-[(2S)-2-hydroxypropyl]benzenesulfonamide
CID 93081235
2-[(2-amino-3,6-dimethylphenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 103171167
2-amino-4,6-dibromo-N-hexan-2-ylbenzenesulfonamide
CID 62198326
2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N-methylacetamide
CID 43310321
2-[(2,5-dibromo-4-methylphenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 80708114
2-amino-4,6-dibromo-N-(1-pyridin-4-ylethyl)benzenesulfonamide
CID 43523955
2-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 43577418
2-[(4-bromo-2-chlorophenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 47203596
2-[(4-amino-3-fluorophenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 82843638
2-[(2-bromo-4-fluorophenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 47304636

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide (CID 43577463) is 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide is CC(NS(=O)(=O)c1c(N)cc(Br)cc1Br)C(=O)N(C)C.
What is the InChIKey of 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide?
The InChIKey is ZRTAFMLPLLJHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Br2N3O3S/c1-6(11(17)16(2)3)15-20(18,19)10-8(13)4-7(12)5-9(10)14/h4-6,15H,14H2,1-3H3.
What are the key properties of 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide?
2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide has a molecular weight of 429.13 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-4,6-dibromophenyl)sulfonylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 43577463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).