2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide

C8H10BrN3O3S — CID 43255728

IUPAC2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide
SMILESNC(=O)CNS(=O)(=O)c1ccc(N)cc1Br
InChIInChI=1S/C8H10BrN3O3S/c9-6-3-5(10)1-2-7(6)16(14,15)12-4-8(11)13/h1-3,12H,4,10H2,(H2,11,13)
InChIKeyZRVCDBXOYPWZIT-UHFFFAOYSA-N
MW308.16 g/mol
LogP-0.21
Rot. Bonds4

About 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide

2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide (PubChem CID 43255728) has the molecular formula C8H10BrN3O3S and a molecular weight of 308.16 g/mol. Its IUPAC name is 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide.

Molecular Properties

Compound Name2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide
PubChem CID43255728
Molecular FormulaC8H10BrN3O3S
Molecular Weight308.16 g/mol
Exact Mass306.96
IUPAC Name2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide
SMILESNC(=O)CNS(=O)(=O)c1ccc(N)cc1Br
InChIInChI=1S/C8H10BrN3O3S/c9-6-3-5(10)1-2-7(6)16(14,15)12-4-8(11)13/h1-3,12H,4,10H2,(H2,11,13)
InChIKeyZRVCDBXOYPWZIT-UHFFFAOYSA-N
XLogP-0.21
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.16
LogP ≤ 5-0.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-amino-2,6-dibromophenyl)sulfonylamino]acetamide
CID 43257086
4-amino-2-bromo-N-(cyclopropylmethyl)benzenesulfonamide
CID 43255757
4-amino-2-bromo-N-(3-hydroxy-2-methylpropyl)benzenesulfonamide
CID 65036761
2-[(4-aminophenyl)sulfonylamino]acetamide
CID 3678127
3-[(5-amino-2-bromophenyl)sulfonylamino]propanamide
CID 65202243
4-amino-2-bromo-N-(2-methylsulfinylethyl)benzenesulfonamide
CID 113479659
4-amino-2-bromo-N-[(4-ethylphenyl)methyl]benzenesulfonamide
CID 106899208
4-amino-2-bromo-N-(2-hydroxy-2-methylpentyl)benzenesulfonamide
CID 106289563
2-[(2,4-dibromophenyl)sulfonylamino]acetic acid
CID 60823111
5-amino-2-bromo-N-(2-hydroxyethyl)benzenesulfonamide
CID 65201907
4-amino-2-bromo-N-[(2-bromo-5-fluorophenyl)methyl]benzenesulfonamide
CID 61127182
4-amino-2-bromo-N-(2-cyclohexyloxyethyl)benzenesulfonamide
CID 63824064

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide?
The IUPAC name of 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide (CID 43255728) is 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide.
What is the SMILES notation for 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide?
The canonical SMILES for 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide is NC(=O)CNS(=O)(=O)c1ccc(N)cc1Br.
What is the InChIKey of 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide?
The InChIKey is ZRVCDBXOYPWZIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN3O3S/c9-6-3-5(10)1-2-7(6)16(14,15)12-4-8(11)13/h1-3,12H,4,10H2,(H2,11,13).
What are the key properties of 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide?
2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide has a molecular weight of 308.16 g/mol, XLogP of -0.21, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide is sourced from PubChem (CID 43255728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).