6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one

C8H7N3OS — CID 135396185

IUPAC6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one
SMILESCc1nnc(-c2cccc(=O)[nH]2)s1
InChIInChI=1S/C8H7N3OS/c1-5-10-11-8(13-5)6-3-2-4-7(12)9-6/h2-4H,1H3,(H,9,12)
InChIKeyNQOFDWAEEYZVRE-UHFFFAOYSA-N
MW193.23 g/mol
LogP1.20
Rot. Bonds1

About 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one

6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one (PubChem CID 135396185) has the molecular formula C8H7N3OS and a molecular weight of 193.23 g/mol. Its IUPAC name is 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one
PubChem CID135396185
Molecular FormulaC8H7N3OS
Molecular Weight193.23 g/mol
Exact Mass193.03
IUPAC Name6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one
SMILESCc1nnc(-c2cccc(=O)[nH]2)s1
InChIInChI=1S/C8H7N3OS/c1-5-10-11-8(13-5)6-3-2-4-7(12)9-6/h2-4H,1H3,(H,9,12)
InChIKeyNQOFDWAEEYZVRE-UHFFFAOYSA-N
XLogP1.20
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1H-indol-2-yl)-5-methyl-1,3,4-thiadiazole
CID 3921207
5-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one
CID 137287503
bis(ethane-1,1-diamine);6-(6-oxo-1H-pyridin-2-yl)-1H-pyridin-2-one
CID 162039075
6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one
CID 106520845
3-(5-methyl-1,3,4-thiadiazol-2-yl)aniline
CID 16763184
2-(6-chloro-2-pyridinyl)-5-methyl-1,3,4-thiadiazole
CID 137347543
2-methyl-5-[4-(4-methylphenyl)phenyl]-1,3,4-thiadiazole
CID 22899617
[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl] carbamate
CID 174464729
2-methyl-5-pyridin-4-yl-1,3,4-thiadiazole
CID 23346364
2-(1H-imidazol-2-yl)-5-methyl-1,3,4-thiadiazole
CID 142566010
azepine-2,7-dione
CID 15094758
2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-oxidoindol-1-ium-3-one
CID 15581154

Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one?
The IUPAC name of 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one (CID 135396185) is 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one is Cc1nnc(-c2cccc(=O)[nH]2)s1.
What is the InChIKey of 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one?
The InChIKey is NQOFDWAEEYZVRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS/c1-5-10-11-8(13-5)6-3-2-4-7(12)9-6/h2-4H,1H3,(H,9,12).
What are the key properties of 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one?
6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one has a molecular weight of 193.23 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 135396185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).