N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide

C12H9BrClNOS — CID 62908415

IUPACN-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1cc(Br)ccc1Cl
InChIInChI=1S/C12H9BrClNOS/c13-8-3-4-10(14)11(6-8)15-12(16)7-9-2-1-5-17-9/h1-6H,7H2,(H,15,16)
InChIKeyGLTHKUYTIRZGMY-UHFFFAOYSA-N
MW330.63 g/mol
LogP4.35
Rot. Bonds3

About N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide

N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide (PubChem CID 62908415) has the molecular formula C12H9BrClNOS and a molecular weight of 330.63 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide
PubChem CID62908415
Molecular FormulaC12H9BrClNOS
Molecular Weight330.63 g/mol
Exact Mass328.93
IUPAC NameN-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1cc(Br)ccc1Cl
InChIInChI=1S/C12H9BrClNOS/c13-8-3-4-10(14)11(6-8)15-12(16)7-9-2-1-5-17-9/h1-6H,7H2,(H,15,16)
InChIKeyGLTHKUYTIRZGMY-UHFFFAOYSA-N
XLogP4.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.63
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 5-bromo-2-[(2-thiophen-2-ylacetyl)amino]benzoate
CID 17415993
N-(4-amino-2-chlorophenyl)-2-thiophen-2-ylacetamide
CID 16783810
N-(2-chloro-4,5-dimethoxyphenyl)-2-thiophen-2-ylacetamide
CID 18139931
4-chloro-N-(2-methylphenyl)-3-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 7312069
N-[2-chloro-5-(tetrazol-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 50777053
2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
CID 55132440
1-(4-bromo-2-chlorophenyl)-2-thiophen-2-ylethanone
CID 61055078
N-(2-hydroxyphenyl)-2-thiophen-2-ylacetamide
CID 837925
N-[4-(2-chloroanilino)phenyl]-2-thiophen-2-ylacetamide
CID 112986929
4-chloro-N-(2-ethoxyphenyl)-3-[(2-thiophen-2-ylacetyl)amino]benzamide
CID 56692214
3-amino-N-[3-chloro-4-[(2-thiophen-2-ylacetyl)amino]phenyl]propanamide
CID 82034683
N-(2-acetamidophenyl)-2-thiophen-2-ylacetamide
CID 1363852

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide (CID 62908415) is N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)Nc1cc(Br)ccc1Cl.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide?
The InChIKey is GLTHKUYTIRZGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrClNOS/c13-8-3-4-10(14)11(6-8)15-12(16)7-9-2-1-5-17-9/h1-6H,7H2,(H,15,16).
What are the key properties of N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide?
N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide has a molecular weight of 330.63 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 62908415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).