2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide

C16H12FNOS — CID 2732602

IUPAC2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide
SMILESO=C(Cc1csc2ccccc12)Nc1ccc(F)cc1
InChIInChI=1S/C16H12FNOS/c17-12-5-7-13(8-6-12)18-16(19)9-11-10-20-15-4-2-1-3-14(11)15/h1-8,10H,9H2,(H,18,19)
InChIKeyPOBDSUNUFJKJGU-UHFFFAOYSA-N
MW285.34 g/mol
LogP4.22
Rot. Bonds3

About 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide

2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide (PubChem CID 2732602) has the molecular formula C16H12FNOS and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide
PubChem CID2732602
Molecular FormulaC16H12FNOS
Molecular Weight285.34 g/mol
Exact Mass285.06
IUPAC Name2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide
SMILESO=C(Cc1csc2ccccc12)Nc1ccc(F)cc1
InChIInChI=1S/C16H12FNOS/c17-12-5-7-13(8-6-12)18-16(19)9-11-10-20-15-4-2-1-3-14(11)15/h1-8,10H,9H2,(H,18,19)
InChIKeyPOBDSUNUFJKJGU-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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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide (CID 2732602) is 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide is O=C(Cc1csc2ccccc12)Nc1ccc(F)cc1.
What is the InChIKey of 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide?
The InChIKey is POBDSUNUFJKJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNOS/c17-12-5-7-13(8-6-12)18-16(19)9-11-10-20-15-4-2-1-3-14(11)15/h1-8,10H,9H2,(H,18,19).
What are the key properties of 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide?
2-(1-benzothiophen-3-yl)-N-(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 2-(1-benzothiophen-3-yl)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 2732602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).