3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol

C13H12FNOS — CID 67721864

IUPAC3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol
SMILESOc1ccc(C2NCCc3ccsc32)c(F)c1
InChIInChI=1S/C13H12FNOS/c14-11-7-9(16)1-2-10(11)12-13-8(3-5-15-12)4-6-17-13/h1-2,4,6-7,12,15-16H,3,5H2
InChIKeySJZUCIGEMZLTJQ-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.83
Rot. Bonds1

About 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol

3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol (PubChem CID 67721864) has the molecular formula C13H12FNOS and a molecular weight of 249.31 g/mol. Its IUPAC name is 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol.

Molecular Properties

Compound Name3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol
PubChem CID67721864
Molecular FormulaC13H12FNOS
Molecular Weight249.31 g/mol
Exact Mass249.06
IUPAC Name3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol
SMILESOc1ccc(C2NCCc3ccsc32)c(F)c1
InChIInChI=1S/C13H12FNOS/c14-11-7-9(16)1-2-10(11)12-13-8(3-5-15-12)4-6-17-13/h1-2,4,6-7,12,15-16H,3,5H2
InChIKeySJZUCIGEMZLTJQ-UHFFFAOYSA-N
XLogP2.83
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol 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

7-(2,3-difluorophenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
CID 54276140
7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
CID 19959701
3-fluoro-4-[(2S,3S)-3-(2-fluoro-4-hydroxyphenyl)piperazin-2-yl]phenol
CID 124672778
1-(2,5-dichlorophenyl)-1,2,3,4-tetrahydroisoquinolin-6-ol
CID 4287883
(1R)-1-(2,4-difluorophenyl)-1,2,3,4-tetrahydroisoquinoline
CID 138690017
7-pyrimidin-5-yl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
CID 165478413
1-(2-amino-5-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
CID 10788933
1-(2-fluoro-3-methoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 106780917
7-fluoro-2-(2-fluoro-4-hydroxyphenyl)-2,4-dihydro-1H-quinolin-3-one
CID 66650407
4-cyclopropyl-3-fluorophenol
CID 83131228
4-(9-bicyclo[3.3.1]nonanyl)-3-fluorophenol
CID 67060997
1-(2-methoxy-5-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinolin-6-ol
CID 5108927

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol?
The IUPAC name of 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol (CID 67721864) is 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol.
What is the SMILES notation for 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol?
The canonical SMILES for 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol is Oc1ccc(C2NCCc3ccsc32)c(F)c1.
What is the InChIKey of 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol?
The InChIKey is SJZUCIGEMZLTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNOS/c14-11-7-9(16)1-2-10(11)12-13-8(3-5-15-12)4-6-17-13/h1-2,4,6-7,12,15-16H,3,5H2.
What are the key properties of 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol?
3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol has a molecular weight of 249.31 g/mol, XLogP of 2.83, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol is sourced from PubChem (CID 67721864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).