6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide

C15H10FNO2S — CID 78911893

IUPAC6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cc2ccc(F)cc2s1
InChIInChI=1S/C15H10FNO2S/c16-10-5-4-9-6-14(20-13(9)7-10)15(19)17-11-2-1-3-12(18)8-11/h1-8,18H,(H,17,19)
InChIKeyLBDGLWICOZVOIG-UHFFFAOYSA-N
MW287.31 g/mol
LogP4.00
Rot. Bonds2

About 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide

6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide (PubChem CID 78911893) has the molecular formula C15H10FNO2S and a molecular weight of 287.31 g/mol. Its IUPAC name is 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide
PubChem CID78911893
Molecular FormulaC15H10FNO2S
Molecular Weight287.31 g/mol
Exact Mass287.04
IUPAC Name6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cc2ccc(F)cc2s1
InChIInChI=1S/C15H10FNO2S/c16-10-5-4-9-6-14(20-13(9)7-10)15(19)17-11-2-1-3-12(18)8-11/h1-8,18H,(H,17,19)
InChIKeyLBDGLWICOZVOIG-UHFFFAOYSA-N
XLogP4.00
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.31
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 869374
N-(2-hydroxy-5-phenylphenyl)-1-benzothiophene-2-carboxamide
CID 44454621
3-hydroxy-N-(3-(trifluoromethyl)phenyl)-1-benzothiophene-2-carboxamide
CID 901311
N-[4-[(3-hydroxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 976646
7-Fluoro-2-(3-hydroxyphenyl)-1,2-benzothiazol-3-one
CID 56666676
5,6-dihydroxy-N-phenyl-1-benzothiophene-2-carboxamide
CID 164618683
N,5-bis(3-hydroxyphenyl)-N-methylthiophene-2-carboxamide
CID 60196494
5-(2-hydroxyphenyl)-N-(3-hydroxyphenyl)-N-methylthiophene-2-carboxamide
CID 60196496
N-(3-hydroxyphenyl)-N-methyl-5-phenylthiophene-2-carboxamide
CID 60196498
N-(3-fluorophenyl)-5-(4-hydroxyphenyl)thiophene-2-carboxamide
CID 137501923
N-(4-fluorophenyl)-5-(3-hydroxyphenyl)thiophene-2-carboxamide
CID 137518253
5-(4-hydroxyphenyl)-N-(4-methylphenyl)thiophene-2-carboxamide
CID 137518255

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide?
The IUPAC name of 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide (CID 78911893) is 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide.
What is the SMILES notation for 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide?
The canonical SMILES for 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide is O=C(Nc1cccc(O)c1)c1cc2ccc(F)cc2s1.
What is the InChIKey of 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide?
The InChIKey is LBDGLWICOZVOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNO2S/c16-10-5-4-9-6-14(20-13(9)7-10)15(19)17-11-2-1-3-12(18)8-11/h1-8,18H,(H,17,19).
What are the key properties of 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide?
6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide has a molecular weight of 287.31 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(3-hydroxyphenyl)-1-benzothiophene-2-carboxamide is sourced from PubChem (CID 78911893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).