2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide

C14H15BrN2O3S2 — CID 7398911

IUPAC2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C14H15BrN2O3S2/c1-2-10-5-3-4-6-11(10)17-13(18)9-16-22(19,20)14-8-7-12(15)21-14/h3-8,16H,2,9H2,1H3,(H,17,18)
InChIKeyMHAQEKZGBAYAOP-UHFFFAOYSA-N
MW403.32 g/mol
LogP2.99
Rot. Bonds6

About 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide

2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide (PubChem CID 7398911) has the molecular formula C14H15BrN2O3S2 and a molecular weight of 403.32 g/mol. Its IUPAC name is 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide
PubChem CID7398911
Molecular FormulaC14H15BrN2O3S2
Molecular Weight403.32 g/mol
Exact Mass401.97
IUPAC Name2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C14H15BrN2O3S2/c1-2-10-5-3-4-6-11(10)17-13(18)9-16-22(19,20)14-8-7-12(15)21-14/h3-8,16H,2,9H2,1H3,(H,17,18)
InChIKeyMHAQEKZGBAYAOP-UHFFFAOYSA-N
XLogP2.99
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.32
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide (CID 7398911) is 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(Br)s1.
What is the InChIKey of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide?
The InChIKey is MHAQEKZGBAYAOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2O3S2/c1-2-10-5-3-4-6-11(10)17-13(18)9-16-22(19,20)14-8-7-12(15)21-14/h3-8,16H,2,9H2,1H3,(H,17,18).
What are the key properties of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide?
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide has a molecular weight of 403.32 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 7398911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).