3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide

C15H10BrNOS2 — CID 60778239

IUPAC3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1-c1cccs1)c1sccc1Br
InChIInChI=1S/C15H10BrNOS2/c16-11-7-9-20-14(11)15(18)17-12-5-2-1-4-10(12)13-6-3-8-19-13/h1-9H,(H,17,18)
InChIKeyHAYNGRYRJUCAEA-UHFFFAOYSA-N
MW364.29 g/mol
LogP5.49
Rot. Bonds3

About 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide

3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide (PubChem CID 60778239) has the molecular formula C15H10BrNOS2 and a molecular weight of 364.29 g/mol. Its IUPAC name is 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
PubChem CID60778239
Molecular FormulaC15H10BrNOS2
Molecular Weight364.29 g/mol
Exact Mass362.94
IUPAC Name3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1-c1cccs1)c1sccc1Br
InChIInChI=1S/C15H10BrNOS2/c16-11-7-9-20-14(11)15(18)17-12-5-2-1-4-10(12)13-6-3-8-19-13/h1-9H,(H,17,18)
InChIKeyHAYNGRYRJUCAEA-UHFFFAOYSA-N
XLogP5.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.29
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
CID 17412743
5-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide
CID 47131134
3-bromo-N-(2-cyanophenyl)thiophene-2-carboxamide
CID 63172712
2-bromo-N-(2-thiophen-2-ylphenyl)pyridine-4-carboxamide
CID 103754168
3-bromo-N-[2-(N-hydroxy-C-methylcarbonimidoyl)phenyl]thiophene-2-carboxamide
CID 77007128
4-fluoro-3-methyl-N-(2-thiophen-2-ylphenyl)-1-benzothiophene-2-carboxamide
CID 24568109
5-bromo-N-(2-thiophen-2-ylphenyl)-1-benzofuran-2-carboxamide
CID 75414714
2-(1,3-dioxoisoindol-2-yl)-N-(2-thiophen-2-ylphenyl)acetamide
CID 51286975
3-bromo-N-(3-chloro-2-fluorophenyl)thiophene-2-carboxamide
CID 60778064
(E)-4-oxo-4-(2-thiophen-2-ylanilino)but-2-enoic acid
CID 54868450
2-[(3-bromothiophene-2-carbonyl)amino]-6-fluorobenzoic acid
CID 55240484
3,5-dichloro-2-iodo-N-(2-thiophen-2-ylphenyl)benzamide
CID 16577558

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide?
The IUPAC name of 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide (CID 60778239) is 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide is O=C(Nc1ccccc1-c1cccs1)c1sccc1Br.
What is the InChIKey of 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide?
The InChIKey is HAYNGRYRJUCAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrNOS2/c16-11-7-9-20-14(11)15(18)17-12-5-2-1-4-10(12)13-6-3-8-19-13/h1-9H,(H,17,18).
What are the key properties of 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide?
3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide has a molecular weight of 364.29 g/mol, XLogP of 5.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(2-thiophen-2-ylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 60778239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).