(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol

C13H9FOS2 — CID 105102714

IUPAC(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol
SMILESOC(c1ccsc1)c1cc2cc(F)ccc2s1
InChIInChI=1S/C13H9FOS2/c14-10-1-2-11-9(5-10)6-12(17-11)13(15)8-3-4-16-7-8/h1-7,13,15H
InChIKeyKQDRGTAETZYQJQ-UHFFFAOYSA-N
MW264.35 g/mol
LogP4.18
Rot. Bonds2

About (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol

(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol (PubChem CID 105102714) has the molecular formula C13H9FOS2 and a molecular weight of 264.35 g/mol. Its IUPAC name is (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol
PubChem CID105102714
Molecular FormulaC13H9FOS2
Molecular Weight264.35 g/mol
Exact Mass264.01
IUPAC Name(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol
SMILESOC(c1ccsc1)c1cc2cc(F)ccc2s1
InChIInChI=1S/C13H9FOS2/c14-10-1-2-11-9(5-10)6-12(17-11)13(15)8-3-4-16-7-8/h1-7,13,15H
InChIKeyKQDRGTAETZYQJQ-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol 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

(5-fluoro-1-benzothiophen-2-yl)-(4-methylphenyl)methanol
CID 105078220
(5-fluoro-1-benzothiophen-2-yl)-(6-methyl-3-pyridinyl)methanol
CID 105096887
(2,5-difluorophenyl)-thiophen-3-ylmethanol
CID 61099759
(3,5-difluorophenyl)-(5-fluoro-1-benzothiophen-2-yl)methanamine
CID 105141971
(5-fluoro-1-benzothiophen-2-yl)-(1-methylpyrazol-3-yl)methanol
CID 103138856
(1S)-1-(5-fluoro-1-benzothiophen-2-yl)ethanamine
CID 55268334
N-ethyl-1-(5-fluoro-1-benzothiophen-2-yl)-2-thiophen-3-ylethanamine
CID 105137624
N-[1-(5-fluoro-1-benzothiophen-2-yl)ethyl]hydroxylamine
CID 19846311
2-(5-fluoro-1-benzothiophen-2-yl)propan-1-ol
CID 117121247
(4-bromophenyl)-(6-fluoro-1-benzothiophen-2-yl)methanol
CID 81104251
(5-bromo-3-methyltriazol-4-yl)-(5-fluoro-1-benzothiophen-2-yl)methanol
CID 106465440
(5-fluoro-1-benzothiophen-2-yl)-phenylmethanamine
CID 105083659

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol?
The IUPAC name of (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol (CID 105102714) is (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol.
What is the SMILES notation for (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol?
The canonical SMILES for (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol is OC(c1ccsc1)c1cc2cc(F)ccc2s1.
What is the InChIKey of (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol?
The InChIKey is KQDRGTAETZYQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FOS2/c14-10-1-2-11-9(5-10)6-12(17-11)13(15)8-3-4-16-7-8/h1-7,13,15H.
What are the key properties of (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol?
(5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol has a molecular weight of 264.35 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-1-benzothiophen-2-yl)-thiophen-3-ylmethanol is sourced from PubChem (CID 105102714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).