2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide

C13H10FNO2S — CID 1486761

IUPAC2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide
SMILESNC(=O)Cc1ccc(C(=O)c2ccc(F)cc2)s1
InChIInChI=1S/C13H10FNO2S/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(18-11)7-12(15)16/h1-6H,7H2,(H2,15,16)
InChIKeyOKWDCWGHUQXVIM-UHFFFAOYSA-N
MW263.29 g/mol
LogP2.15
Rot. Bonds4

About 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide

2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide (PubChem CID 1486761) has the molecular formula C13H10FNO2S and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide.

Molecular Properties

Compound Name2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide
PubChem CID1486761
Molecular FormulaC13H10FNO2S
Molecular Weight263.29 g/mol
Exact Mass263.04
IUPAC Name2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide
SMILESNC(=O)Cc1ccc(C(=O)c2ccc(F)cc2)s1
InChIInChI=1S/C13H10FNO2S/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(18-11)7-12(15)16/h1-6H,7H2,(H2,15,16)
InChIKeyOKWDCWGHUQXVIM-UHFFFAOYSA-N
XLogP2.15
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide?
The IUPAC name of 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide (CID 1486761) is 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide.
What is the SMILES notation for 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide?
The canonical SMILES for 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide is NC(=O)Cc1ccc(C(=O)c2ccc(F)cc2)s1.
What is the InChIKey of 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide?
The InChIKey is OKWDCWGHUQXVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO2S/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(18-11)7-12(15)16/h1-6H,7H2,(H2,15,16).
What are the key properties of 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide?
2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide has a molecular weight of 263.29 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-fluorobenzoyl)thiophen-2-yl]acetamide is sourced from PubChem (CID 1486761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).