(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol

C9H9N3O2S — CID 105121227

IUPAC(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol
SMILESCOc1cncc(C(O)c2csnn2)c1
InChIInChI=1S/C9H9N3O2S/c1-14-7-2-6(3-10-4-7)9(13)8-5-15-12-11-8/h2-5,9,13H,1H3
InChIKeyYFXXAZHUUDWVMX-UHFFFAOYSA-N
MW223.26 g/mol
LogP1.02
Rot. Bonds3

About (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol

(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol (PubChem CID 105121227) has the molecular formula C9H9N3O2S and a molecular weight of 223.26 g/mol. Its IUPAC name is (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol.

Molecular Properties

Compound Name(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol
PubChem CID105121227
Molecular FormulaC9H9N3O2S
Molecular Weight223.26 g/mol
Exact Mass223.04
IUPAC Name(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol
SMILESCOc1cncc(C(O)c2csnn2)c1
InChIInChI=1S/C9H9N3O2S/c1-14-7-2-6(3-10-4-7)9(13)8-5-15-12-11-8/h2-5,9,13H,1H3
InChIKeyYFXXAZHUUDWVMX-UHFFFAOYSA-N
XLogP1.02
TPSA68.13 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)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

(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950306
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(5-methoxy-3-pyridinyl)-(1-methylimidazol-4-yl)methanol
CID 107978609
2,2-difluoro-1-(5-methoxy-3-pyridinyl)ethanol
CID 112575542
4-methoxy-1-(5-methoxy-3-pyridinyl)-3-methylbutan-1-ol
CID 105121262
(5-chlorofuran-2-yl)-(5-methoxy-3-pyridinyl)methanol
CID 106693953
3-(dimethoxymethyl)-5-methoxypyridine
CID 45361740
(5-methoxy-3-pyridinyl)-(3-methylfuran-2-yl)methanol
CID 104800797
(5-methoxy-3-pyridinyl)-(2,3,4-trifluorophenyl)methanol
CID 115828863
(5-bromo-2-methylphenyl)-(5-methoxy-3-pyridinyl)methanol
CID 115828827
(4-chloro-2,5-difluorophenyl)-(5-methoxy-3-pyridinyl)methanol
CID 115828955
1-(5-methoxy-3-pyridinyl)-2-thiophen-3-ylethanol
CID 105121291

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol?
The IUPAC name of (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol (CID 105121227) is (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol.
What is the SMILES notation for (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol?
The canonical SMILES for (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol is COc1cncc(C(O)c2csnn2)c1.
What is the InChIKey of (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol?
The InChIKey is YFXXAZHUUDWVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2S/c1-14-7-2-6(3-10-4-7)9(13)8-5-15-12-11-8/h2-5,9,13H,1H3.
What are the key properties of (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol?
(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol has a molecular weight of 223.26 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol is sourced from PubChem (CID 105121227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).