1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol

C15H13NO2S — CID 103347973

IUPAC1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol
SMILESCOc1cccc(C(O)c2cccc3ccsc23)n1
InChIInChI=1S/C15H13NO2S/c1-18-13-7-3-6-12(16-13)14(17)11-5-2-4-10-8-9-19-15(10)11/h2-9,14,17H,1H3
InChIKeyLTAFNNHEKMWBHZ-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.39
Rot. Bonds3

About 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol

1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol (PubChem CID 103347973) has the molecular formula C15H13NO2S and a molecular weight of 271.34 g/mol. Its IUPAC name is 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol.

Molecular Properties

Compound Name1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol
PubChem CID103347973
Molecular FormulaC15H13NO2S
Molecular Weight271.34 g/mol
Exact Mass271.07
IUPAC Name1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol
SMILESCOc1cccc(C(O)c2cccc3ccsc23)n1
InChIInChI=1S/C15H13NO2S/c1-18-13-7-3-6-12(16-13)14(17)11-5-2-4-10-8-9-19-15(10)11/h2-9,14,17H,1H3
InChIKeyLTAFNNHEKMWBHZ-UHFFFAOYSA-N
XLogP3.39
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol 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

rac-2-(3-(1-(6-methoxypyridin-2-yl)ethyl)benzo[b]thiophen-2-yl)-N,N-dimethylethanamine
CID 11530223
2-Methoxy-6-(3-thienyl)pyridine
CID 49761849
2-(1-Benzothiophen-2-yl)-6-methoxypyridine
CID 57543413
2-Amino-1-[6-(7-fluoro-1-benzothiophen-3-yl)-5-methoxy-2-pyridinyl]ethanol
CID 90043086
2-Amino-2-[6-(7-fluoro-1-benzothiophen-3-yl)-5-methoxy-2-pyridinyl]ethanol
CID 90043088
2-Amino-1-[6-(7-fluoro-1-benzothiophen-3-yl)-4-methoxy-2-pyridinyl]ethanol
CID 117926616
(5-Chlorothiophen-3-yl)-[6-(4-fluorophenoxy)-2-pyridinyl]methanol
CID 118384478
3-[6-[[2-Methyl-6-(trifluoromethyl)-3-pyridinyl]methoxy]-1-benzothiophen-3-yl]prop-1-en-2-ol
CID 130284321
3-[6-[[2-Methyl-6-(trifluoromethyl)-3-pyridinyl]methoxy]-4-phosphanyl-1-benzothiophen-3-yl]prop-1-en-2-ol
CID 130284414
[2-(5-Cyclohexyloxy-6-methyl-2-pyridinyl)-5-fluorothiophen-3-yl]methanol
CID 167071196
2-Phenylmethoxy-6-thiophen-2-ylpyridine
CID 101897269
2-Methoxy-3-(4-methoxyphenyl)-6-(2-thienyl)pyridine
CID 138757019

Frequently Asked Questions

What is the IUPAC name of 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol?
The IUPAC name of 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol (CID 103347973) is 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol.
What is the SMILES notation for 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol?
The canonical SMILES for 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol is COc1cccc(C(O)c2cccc3ccsc23)n1.
What is the InChIKey of 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol?
The InChIKey is LTAFNNHEKMWBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2S/c1-18-13-7-3-6-12(16-13)14(17)11-5-2-4-10-8-9-19-15(10)11/h2-9,14,17H,1H3.
What are the key properties of 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol?
1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol has a molecular weight of 271.34 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzothiophen-7-yl-(6-methoxy-2-pyridinyl)methanol is sourced from PubChem (CID 103347973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).