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

C10H16BrN3O3S2 — CID 112991518

IUPAC2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)CNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C10H16BrN3O3S2/c1-14(2)6-5-12-9(15)7-13-19(16,17)10-4-3-8(11)18-10/h3-4,13H,5-7H2,1-2H3,(H,12,15)
InChIKeyPXQUXGOVWZLYLC-UHFFFAOYSA-N
MW370.29 g/mol
LogP0.47
Rot. Bonds7

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

2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide (PubChem CID 112991518) has the molecular formula C10H16BrN3O3S2 and a molecular weight of 370.29 g/mol. Its IUPAC name is 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
PubChem CID112991518
Molecular FormulaC10H16BrN3O3S2
Molecular Weight370.29 g/mol
Exact Mass368.98
IUPAC Name2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)CNS(=O)(=O)c1ccc(Br)s1
InChIInChI=1S/C10H16BrN3O3S2/c1-14(2)6-5-12-9(15)7-13-19(16,17)10-4-3-8(11)18-10/h3-4,13H,5-7H2,1-2H3,(H,12,15)
InChIKeyPXQUXGOVWZLYLC-UHFFFAOYSA-N
XLogP0.47
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.29
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

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

Launch Full Analysis

Related Compounds

2-[(5-bromothiophen-2-yl)sulfonylamino]-N-propan-2-ylacetamide
CID 9189604
N-benzyl-2-[(5-bromothiophen-2-yl)sulfonylamino]acetamide
CID 6621397
N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide
CID 112991485
3-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylpropanamide
CID 61060598
methyl 2-[[2-[(5-bromothiophen-2-yl)sulfonylamino]acetyl]amino]-2-methylpropanoate
CID 51131047
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(4-chlorophenyl)acetamide
CID 15999318
2-[(3,4-dichlorophenyl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
CID 112991491
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-cyclohexylacetamide
CID 15992302
N-(1-aminopropan-2-yl)-2-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylacetamide;hydrochloride
CID 119585221
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-(piperidin-3-ylmethyl)acetamide
CID 119464585
methyl 2-[[2-[(5-bromothiophen-2-yl)sulfonylamino]acetyl]amino]-4-methylpentanoate
CID 3298389
3-[(5-bromothiophen-2-yl)sulfonylamino]propanoate
CID 4084125

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide (CID 112991518) is 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide is CN(C)CCNC(=O)CNS(=O)(=O)c1ccc(Br)s1.
What is the InChIKey of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide?
The InChIKey is PXQUXGOVWZLYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN3O3S2/c1-14(2)6-5-12-9(15)7-13-19(16,17)10-4-3-8(11)18-10/h3-4,13H,5-7H2,1-2H3,(H,12,15).
What are the key properties of 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide?
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide has a molecular weight of 370.29 g/mol, XLogP of 0.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 112991518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).