N-(5-bromo-1-benzothiophen-2-yl)acetamide

C10H8BrNOS — CID 615286

IUPACN-(5-bromo-1-benzothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc2cc(Br)ccc2s1
InChIInChI=1S/C10H8BrNOS/c1-6(13)12-10-5-7-4-8(11)2-3-9(7)14-10/h2-5H,1H3,(H,12,13)
InChIKeyRDLXKVURQWRJEF-UHFFFAOYSA-N
MW270.15 g/mol
LogP3.62
Rot. Bonds1

About N-(5-bromo-1-benzothiophen-2-yl)acetamide

N-(5-bromo-1-benzothiophen-2-yl)acetamide (PubChem CID 615286) has the molecular formula C10H8BrNOS and a molecular weight of 270.15 g/mol. Its IUPAC name is N-(5-bromo-1-benzothiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-1-benzothiophen-2-yl)acetamide
PubChem CID615286
Molecular FormulaC10H8BrNOS
Molecular Weight270.15 g/mol
Exact Mass268.95
IUPAC NameN-(5-bromo-1-benzothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc2cc(Br)ccc2s1
InChIInChI=1S/C10H8BrNOS/c1-6(13)12-10-5-7-4-8(11)2-3-9(7)14-10/h2-5H,1H3,(H,12,13)
InChIKeyRDLXKVURQWRJEF-UHFFFAOYSA-N
XLogP3.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.15
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1-benzothiophen-2-yl)acetamide?
The IUPAC name of N-(5-bromo-1-benzothiophen-2-yl)acetamide (CID 615286) is N-(5-bromo-1-benzothiophen-2-yl)acetamide.
What is the SMILES notation for N-(5-bromo-1-benzothiophen-2-yl)acetamide?
The canonical SMILES for N-(5-bromo-1-benzothiophen-2-yl)acetamide is CC(=O)Nc1cc2cc(Br)ccc2s1.
What is the InChIKey of N-(5-bromo-1-benzothiophen-2-yl)acetamide?
The InChIKey is RDLXKVURQWRJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrNOS/c1-6(13)12-10-5-7-4-8(11)2-3-9(7)14-10/h2-5H,1H3,(H,12,13).
What are the key properties of N-(5-bromo-1-benzothiophen-2-yl)acetamide?
N-(5-bromo-1-benzothiophen-2-yl)acetamide has a molecular weight of 270.15 g/mol, XLogP of 3.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1-benzothiophen-2-yl)acetamide is sourced from PubChem (CID 615286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).