(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol

C8H7N3OS — CID 58504238

IUPAC(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
SMILESOCc1nnc(-c2ccccn2)s1
InChIInChI=1S/C8H7N3OS/c12-5-7-10-11-8(13-7)6-3-1-2-4-9-6/h1-4,12H,5H2
InChIKeyUWAKZTJPJDCUER-UHFFFAOYSA-N
MW193.23 g/mol
LogP1.09
Rot. Bonds2

About (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol

(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol (PubChem CID 58504238) has the molecular formula C8H7N3OS and a molecular weight of 193.23 g/mol. Its IUPAC name is (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol.

Molecular Properties

Compound Name(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
PubChem CID58504238
Molecular FormulaC8H7N3OS
Molecular Weight193.23 g/mol
Exact Mass193.03
IUPAC Name(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
SMILESOCc1nnc(-c2ccccn2)s1
InChIInChI=1S/C8H7N3OS/c12-5-7-10-11-8(13-7)6-3-1-2-4-9-6/h1-4,12H,5H2
InChIKeyUWAKZTJPJDCUER-UHFFFAOYSA-N
XLogP1.09
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (5-pyridin-2-yl-1,3,4-thiadiazol-2-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

2-ethyl-5-pyridin-2-yl-1,3,4-thiadiazole
CID 101460116
2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole
CID 135397065
5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 159760576
3-[[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)amino]methyl]pentan-3-ol
CID 133442973
1-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)butan-1-ol
CID 130412460
2-(2-methylpentan-3-yl)-5-pyridin-2-yl-1,3,4-thiadiazole
CID 123183756
2-(pyridin-2-ylmethyl)-3-[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)amino]propan-1-ol
CID 133455211
2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 647177
N-ethyl-N-(2-methylprop-2-enyl)-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133467966
4-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pentanamide
CID 47251913
(6-pyridin-2-ylpyridazin-3-yl)methanol
CID 130123433
N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
CID 654941

Frequently Asked Questions

What is the IUPAC name of (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol?
The IUPAC name of (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol (CID 58504238) is (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol.
What is the SMILES notation for (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol?
The canonical SMILES for (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol is OCc1nnc(-c2ccccn2)s1.
What is the InChIKey of (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol?
The InChIKey is UWAKZTJPJDCUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS/c12-5-7-10-11-8(13-7)6-3-1-2-4-9-6/h1-4,12H,5H2.
What are the key properties of (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol?
(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol has a molecular weight of 193.23 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol is sourced from PubChem (CID 58504238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).