2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide

C11H15BrN2O3S — CID 18192043

IUPAC2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide
SMILESCCCNC(=O)CNS(=O)(=O)c1ccccc1Br
InChIInChI=1S/C11H15BrN2O3S/c1-2-7-13-11(15)8-14-18(16,17)10-6-4-3-5-9(10)12/h3-6,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyGNHIWGIMBGXIBV-UHFFFAOYSA-N
MW335.22 g/mol
LogP1.25
Rot. Bonds6

About 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide

2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide (PubChem CID 18192043) has the molecular formula C11H15BrN2O3S and a molecular weight of 335.22 g/mol. Its IUPAC name is 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide
PubChem CID18192043
Molecular FormulaC11H15BrN2O3S
Molecular Weight335.22 g/mol
Exact Mass334.00
IUPAC Name2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide
SMILESCCCNC(=O)CNS(=O)(=O)c1ccccc1Br
InChIInChI=1S/C11H15BrN2O3S/c1-2-7-13-11(15)8-14-18(16,17)10-6-4-3-5-9(10)12/h3-6,14H,2,7-8H2,1H3,(H,13,15)
InChIKeyGNHIWGIMBGXIBV-UHFFFAOYSA-N
XLogP1.25
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.22
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[(2-bromophenyl)sulfonylamino]acetyl]amino]-N-ethylacetamide
CID 9224655
2-[(2-bromo-4-fluorophenyl)sulfonylamino]-N-propylacetamide
CID 60824850
2-[(2-bromophenyl)sulfonylamino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 9391761
3-[(2-bromophenyl)sulfonylamino]-N-[2-(ethylamino)-2-oxoethyl]propanamide
CID 9224808
2-[[2-(3-hydroxyprop-1-ynyl)phenyl]sulfonylamino]-N-propylacetamide
CID 60824642
2-(2,6-dibromoanilino)-N-propylacetamide
CID 107598911
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-propylacetamide
CID 17428914
2-[(5-bromo-2-nitrophenyl)sulfonylamino]-N-propylacetamide
CID 61016948
N-propyl-2-(2-sulfamoylanilino)acetamide
CID 43567437
2-bromo-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162727
2-[(2-bromo-4,6-difluorophenyl)sulfonylamino]-N-propylacetamide
CID 60628452
2-[(2-amino-4-fluorophenyl)sulfonylamino]-N-propylacetamide
CID 43567163

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide?
The IUPAC name of 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide (CID 18192043) is 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide.
What is the SMILES notation for 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide?
The canonical SMILES for 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide is CCCNC(=O)CNS(=O)(=O)c1ccccc1Br.
What is the InChIKey of 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide?
The InChIKey is GNHIWGIMBGXIBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O3S/c1-2-7-13-11(15)8-14-18(16,17)10-6-4-3-5-9(10)12/h3-6,14H,2,7-8H2,1H3,(H,13,15).
What are the key properties of 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide?
2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide has a molecular weight of 335.22 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)sulfonylamino]-N-propylacetamide is sourced from PubChem (CID 18192043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).