N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide

C16H12FNOS — CID 7597232

IUPACN-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc2sccc2c1
InChIInChI=1S/C16H12FNOS/c17-13-3-1-11(2-4-13)9-16(19)18-14-5-6-15-12(10-14)7-8-20-15/h1-8,10H,9H2,(H,18,19)
InChIKeyQYVNHKJNMQELFE-UHFFFAOYSA-N
MW285.34 g/mol
LogP4.22
Rot. Bonds3

About N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide

N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide (PubChem CID 7597232) has the molecular formula C16H12FNOS and a molecular weight of 285.34 g/mol. Its IUPAC name is N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide
PubChem CID7597232
Molecular FormulaC16H12FNOS
Molecular Weight285.34 g/mol
Exact Mass285.06
IUPAC NameN-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc2sccc2c1
InChIInChI=1S/C16H12FNOS/c17-13-3-1-11(2-4-13)9-16(19)18-14-5-6-15-12(10-14)7-8-20-15/h1-8,10H,9H2,(H,18,19)
InChIKeyQYVNHKJNMQELFE-UHFFFAOYSA-N
XLogP4.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-Benzothiophen-3-yl)acetamide
CID 746770
N-(1-benzothiophen-5-yl)acetamide
CID 3290886
N-(4-fluorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 939900
N-(2-fluorophenyl)-2-thiophen-3-ylacetamide
CID 4805494
N-(1-benzothiophen-5-yl)-2-methylsulfonylbenzamide
CID 7267028
N-phenyl-1-benzothiophene-2-carboxamide
CID 237071
N-hydroxy-5-(2-phenylacetamido)benzo[b]thiophene-2-carboxamide
CID 11267357
5-Benzoylamino-benzo[b]thiophene-2-carboxylic acid hydroxyamide
CID 11461110
6-(2-(4-fluorophenyl)acetamido)-N-hydroxybenzo[b]thiophene-2-carboxamide
CID 11772295
[3-(1-Benzothiophene-2-carbonylamino)phenyl]boronic acid
CID 52939999
N-(1-benzothiophen-5-yl)-3-(2,5-dioxopyrrolidin-1-yl)benzamide
CID 3632857
N-(2-fluorophenyl)-5-phenylthiophene-2-carboxamide
CID 16012294

Frequently Asked Questions

What is the IUPAC name of N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide (CID 7597232) is N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1ccc2sccc2c1.
What is the InChIKey of N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide?
The InChIKey is QYVNHKJNMQELFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNOS/c17-13-3-1-11(2-4-13)9-16(19)18-14-5-6-15-12(10-14)7-8-20-15/h1-8,10H,9H2,(H,18,19).
What are the key properties of N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide?
N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide has a molecular weight of 285.34 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzothiophen-5-yl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 7597232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).