5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide

C11H6Br2FNOS — CID 61076675

IUPAC5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(Br)ccc1F)c1ccc(Br)s1
InChIInChI=1S/C11H6Br2FNOS/c12-6-1-2-7(14)8(5-6)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16)
InChIKeyCHKIEZWRKIATKN-UHFFFAOYSA-N
MW379.05 g/mol
LogP4.66
Rot. Bonds2

About 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide

5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide (PubChem CID 61076675) has the molecular formula C11H6Br2FNOS and a molecular weight of 379.05 g/mol. Its IUPAC name is 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide
PubChem CID61076675
Molecular FormulaC11H6Br2FNOS
Molecular Weight379.05 g/mol
Exact Mass376.85
IUPAC Name5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide
SMILESO=C(Nc1cc(Br)ccc1F)c1ccc(Br)s1
InChIInChI=1S/C11H6Br2FNOS/c12-6-1-2-7(14)8(5-6)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16)
InChIKeyCHKIEZWRKIATKN-UHFFFAOYSA-N
XLogP4.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.05
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 28938680
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CID 43555883
5-bromo-N-[4-fluoro-3-(methanesulfonamido)phenyl]thiophene-2-carboxamide
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N-(5-bromo-2-fluorophenyl)pyridine-4-carboxamide
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5-bromo-N-(3-chloro-5-fluorophenyl)thiophene-2-carboxamide
CID 103774691
5-bromo-N-[5-chloro-2-(dimethylamino)phenyl]thiophene-2-carboxamide
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N-(4-amino-2-bromophenyl)-5-bromothiophene-2-carboxamide
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5-bromo-N'-(3,4-difluorobenzoyl)thiophene-2-carbohydrazide
CID 30497119
N-(2,5-difluorophenyl)-5-methylthiophene-2-carboxamide
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N-(5-bromo-2-fluorophenyl)-3,4-dihydroxybenzamide
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CID 82015439

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide?
The IUPAC name of 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide (CID 61076675) is 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide is O=C(Nc1cc(Br)ccc1F)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide?
The InChIKey is CHKIEZWRKIATKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Br2FNOS/c12-6-1-2-7(14)8(5-6)15-11(16)9-3-4-10(13)17-9/h1-5H,(H,15,16).
What are the key properties of 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide?
5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide has a molecular weight of 379.05 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(5-bromo-2-fluorophenyl)thiophene-2-carboxamide is sourced from PubChem (CID 61076675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).