2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide

C7H8BrNO2S — CID 102843536

IUPAC2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide
SMILESCc1sc(C(O)C(N)=O)cc1Br
InChIInChI=1S/C7H8BrNO2S/c1-3-4(8)2-5(12-3)6(10)7(9)11/h2,6,10H,1H3,(H2,9,11)
InChIKeyQCBIHSPRUYOMJA-UHFFFAOYSA-N
MW250.12 g/mol
LogP1.34
Rot. Bonds2

About 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide

2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide (PubChem CID 102843536) has the molecular formula C7H8BrNO2S and a molecular weight of 250.12 g/mol. Its IUPAC name is 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide.

Molecular Properties

Compound Name2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide
PubChem CID102843536
Molecular FormulaC7H8BrNO2S
Molecular Weight250.12 g/mol
Exact Mass248.95
IUPAC Name2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide
SMILESCc1sc(C(O)C(N)=O)cc1Br
InChIInChI=1S/C7H8BrNO2S/c1-3-4(8)2-5(12-3)6(10)7(9)11/h2,6,10H,1H3,(H2,9,11)
InChIKeyQCBIHSPRUYOMJA-UHFFFAOYSA-N
XLogP1.34
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.12
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide 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

(1R)-1-(4-bromo-5-methylthiophen-2-yl)ethanamine
CID 102839149
2-(4-bromo-5-methylthiophen-2-yl)-2-(4-chloroanilino)acetamide
CID 102840307
2-(4-bromo-5-methylthiophen-2-yl)-2-(4-fluoroanilino)acetamide
CID 102840245
2-(4-bromo-5-methylthiophen-2-yl)-2-chloro-N,N-dimethylacetamide
CID 102844189
1-(4-bromo-5-methylthiophen-2-yl)-2-methylsulfonylethanol
CID 102834626
1-(4-bromo-5-methylthiophen-2-yl)pentan-1-ol
CID 102829531
3-bromo-5-(1-bromo-2,2-difluoroethyl)-2-methylthiophene
CID 103514682
(4-bromo-5-methylthiophen-2-yl)-(1-methylcyclopropyl)methanamine
CID 130553169
2-[1-[2-amino-2-(4-bromo-5-methylthiophen-2-yl)ethyl]cyclohexyl]acetamide
CID 102828933
1-(4-bromo-5-methylthiophen-2-yl)-4-methylsulfonylbutan-1-ol
CID 102829631
2-(4-bromo-5-methylthiophen-2-yl)-2-chloro-1-pyrrolidin-1-ylethanone
CID 102844195
methyl 5-amino-5-(4-bromo-5-methylthiophen-2-yl)-3-methylpentanoate
CID 102828928

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide?
The IUPAC name of 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide (CID 102843536) is 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide.
What is the SMILES notation for 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide?
The canonical SMILES for 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide is Cc1sc(C(O)C(N)=O)cc1Br.
What is the InChIKey of 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide?
The InChIKey is QCBIHSPRUYOMJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO2S/c1-3-4(8)2-5(12-3)6(10)7(9)11/h2,6,10H,1H3,(H2,9,11).
What are the key properties of 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide?
2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide has a molecular weight of 250.12 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-5-methylthiophen-2-yl)-2-hydroxyacetamide is sourced from PubChem (CID 102843536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).