5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide

C11H7BrClNOS — CID 43424533

IUPAC5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1csc(Br)c1
InChIInChI=1S/C11H7BrClNOS/c12-10-5-7(6-16-10)11(15)14-9-3-1-8(13)2-4-9/h1-6H,(H,14,15)
InChIKeyWICUTJOEXSDADI-UHFFFAOYSA-N
MW316.61 g/mol
LogP4.42
Rot. Bonds2

About 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide

5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide (PubChem CID 43424533) has the molecular formula C11H7BrClNOS and a molecular weight of 316.61 g/mol. Its IUPAC name is 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide
PubChem CID43424533
Molecular FormulaC11H7BrClNOS
Molecular Weight316.61 g/mol
Exact Mass314.91
IUPAC Name5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1csc(Br)c1
InChIInChI=1S/C11H7BrClNOS/c12-10-5-7(6-16-10)11(15)14-9-3-1-8(13)2-4-9/h1-6H,(H,14,15)
InChIKeyWICUTJOEXSDADI-UHFFFAOYSA-N
XLogP4.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.61
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-[4-(chloromethyl)phenyl]thiophene-3-carboxamide
CID 107966029
5-bromo-N-(4-fluoro-3-methylphenyl)thiophene-3-carboxamide
CID 62812532
N-(2-amino-5-chlorophenyl)-5-bromothiophene-3-carboxamide
CID 107959269
2-[(5-bromothiophene-3-carbonyl)amino]-4-chlorobenzoic acid
CID 43354294
N-[4-(3-aminoprop-1-ynyl)phenyl]-5-bromothiophene-3-carboxamide
CID 107963980
5-bromo-N-[4-(diethylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 94042730
N-[4-(2-amino-2-sulfanylideneethyl)phenyl]-5-bromothiophene-3-carboxamide
CID 107961757
5-bromo-N-(3,5-difluorophenyl)thiophene-3-carboxamide
CID 39642819
5-bromo-N-(3-bromo-4-methoxyphenyl)thiophene-3-carboxamide
CID 63999218
3,5-dichloro-N-(4-chlorophenyl)benzamide
CID 3382216
5-bromo-N-[4-[2-(dimethylamino)ethoxy]phenyl]thiophene-3-carboxamide
CID 60793170
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide?
The IUPAC name of 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide (CID 43424533) is 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide?
The canonical SMILES for 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide is O=C(Nc1ccc(Cl)cc1)c1csc(Br)c1.
What is the InChIKey of 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide?
The InChIKey is WICUTJOEXSDADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrClNOS/c12-10-5-7(6-16-10)11(15)14-9-3-1-8(13)2-4-9/h1-6H,(H,14,15).
What are the key properties of 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide?
5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide has a molecular weight of 316.61 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-chlorophenyl)thiophene-3-carboxamide is sourced from PubChem (CID 43424533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).