2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide

C15H16FNO2S — CID 104917044

IUPAC2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide
SMILESCCCC(NC(=O)c1c(O)cccc1F)c1cccs1
InChIInChI=1S/C15H16FNO2S/c1-2-5-11(13-8-4-9-20-13)17-15(19)14-10(16)6-3-7-12(14)18/h3-4,6-9,11,18H,2,5H2,1H3,(H,17,19)
InChIKeyRZXMLMWSTJFODB-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.86
Rot. Bonds5

About 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide

2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide (PubChem CID 104917044) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide.

Molecular Properties

Compound Name2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide
PubChem CID104917044
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC Name2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide
SMILESCCCC(NC(=O)c1c(O)cccc1F)c1cccs1
InChIInChI=1S/C15H16FNO2S/c1-2-5-11(13-8-4-9-20-13)17-15(19)14-10(16)6-3-7-12(14)18/h3-4,6-9,11,18H,2,5H2,1H3,(H,17,19)
InChIKeyRZXMLMWSTJFODB-UHFFFAOYSA-N
XLogP3.86
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2,6-difluoro-N-(1-thiophen-2-ylbutyl)benzamide
CID 79758784
2-[(2-fluoro-6-hydroxybenzoyl)amino]-2-thiophen-2-ylacetic acid
CID 107013766
2-fluoro-5-methyl-N-(1-thiophen-2-ylbutyl)benzamide
CID 62513846
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
CID 103515707
2-bromo-5-fluoro-N-(1-thiophen-2-ylbutyl)benzamide
CID 61381188
4-(methylamino)-N-(1-thiophen-2-ylbutyl)benzamide
CID 62173495
[4-(2,6-difluorophenyl)-4-oxo-1-thiophen-2-ylbutyl]carbamic acid
CID 142161132
3-oxo-3-(1-thiophen-2-ylbutylamino)propanoic acid
CID 62231148
2-bromo-N-(1-thiophen-2-ylbutyl)propanamide
CID 107904985
6-oxo-N-(1-thiophen-2-ylbutyl)-1H-pyridine-3-carboxamide
CID 61381400
5-bromo-N-(1-thiophen-2-ylbutyl)furan-2-carboxamide
CID 61380869
2,3-dihydroxy-N-(1-thiophen-2-ylpropyl)benzamide
CID 114344112

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide?
The IUPAC name of 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide (CID 104917044) is 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide.
What is the SMILES notation for 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide?
The canonical SMILES for 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide is CCCC(NC(=O)c1c(O)cccc1F)c1cccs1.
What is the InChIKey of 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide?
The InChIKey is RZXMLMWSTJFODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c1-2-5-11(13-8-4-9-20-13)17-15(19)14-10(16)6-3-7-12(14)18/h3-4,6-9,11,18H,2,5H2,1H3,(H,17,19).
What are the key properties of 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide?
2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide has a molecular weight of 293.36 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide is sourced from PubChem (CID 104917044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).