5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide

C13H12FNO2S — CID 79531846

IUPAC5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide
SMILESO=C(NCCc1cccs1)c1cc(F)ccc1O
InChIInChI=1S/C13H12FNO2S/c14-9-3-4-12(16)11(8-9)13(17)15-6-5-10-2-1-7-18-10/h1-4,7-8,16H,5-6H2,(H,15,17)
InChIKeyBNDAVNREBXJWKB-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.57
Rot. Bonds4

About 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide

5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide (PubChem CID 79531846) has the molecular formula C13H12FNO2S and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide
PubChem CID79531846
Molecular FormulaC13H12FNO2S
Molecular Weight265.31 g/mol
Exact Mass265.06
IUPAC Name5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide
SMILESO=C(NCCc1cccs1)c1cc(F)ccc1O
InChIInChI=1S/C13H12FNO2S/c14-9-3-4-12(16)11(8-9)13(17)15-6-5-10-2-1-7-18-10/h1-4,7-8,16H,5-6H2,(H,15,17)
InChIKeyBNDAVNREBXJWKB-UHFFFAOYSA-N
XLogP2.57
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-difluoro-N-(2-thiophen-2-ylethyl)benzamide
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5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
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5-fluoro-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide
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5-fluoro-2-hydroxy-N-(4-hydroxybutyl)benzamide
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CID 110788173
5-bromo-2-chloro-N-(2-thiophen-2-ylethyl)benzamide
CID 27770225
2,4,5-trimethoxy-N-(2-thiophen-2-ylethyl)benzamide
CID 32969473
[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-amino-4-fluorobenzoate
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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide (CID 79531846) is 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide is O=C(NCCc1cccs1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide?
The InChIKey is BNDAVNREBXJWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2S/c14-9-3-4-12(16)11(8-9)13(17)15-6-5-10-2-1-7-18-10/h1-4,7-8,16H,5-6H2,(H,15,17).
What are the key properties of 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide?
5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide has a molecular weight of 265.31 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-(2-thiophen-2-ylethyl)benzamide is sourced from PubChem (CID 79531846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).