5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide

C8H6N4OS — CID 159760576

IUPAC5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
SMILESNC(=O)c1nnc(-c2ccccn2)s1
InChIInChI=1S/C8H6N4OS/c9-6(13)8-12-11-7(14-8)5-3-1-2-4-10-5/h1-4H,(H2,9,13)
InChIKeyNEVBYRRRRAEHKZ-UHFFFAOYSA-N
MW206.23 g/mol
LogP0.70
Rot. Bonds2

About 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide

5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide (PubChem CID 159760576) has the molecular formula C8H6N4OS and a molecular weight of 206.23 g/mol. Its IUPAC name is 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide.

Molecular Properties

Compound Name5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
PubChem CID159760576
Molecular FormulaC8H6N4OS
Molecular Weight206.23 g/mol
Exact Mass206.03
IUPAC Name5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
SMILESNC(=O)c1nnc(-c2ccccn2)s1
InChIInChI=1S/C8H6N4OS/c9-6(13)8-12-11-7(14-8)5-3-1-2-4-10-5/h1-4H,(H2,9,13)
InChIKeyNEVBYRRRRAEHKZ-UHFFFAOYSA-N
XLogP0.70
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.23
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-amino-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
CID 119855704
2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole
CID 135397065
5-pyridin-2-ylthiophene-2-carboxamide
CID 2778719
(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
CID 58504238
1-amino-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119855739
N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-2-carboxamide
CID 654941
1-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)azetidine-3-carboxylic acid
CID 122064429
2-ethyl-5-pyridin-2-yl-1,3,4-thiadiazole
CID 101460116
7-amino-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)heptanamide
CID 119855706
2-methoxy-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 647177
4-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pentanamide
CID 47251913
2-methoxy-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide
CID 167988705

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide?
The IUPAC name of 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide (CID 159760576) is 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide.
What is the SMILES notation for 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide?
The canonical SMILES for 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide is NC(=O)c1nnc(-c2ccccn2)s1.
What is the InChIKey of 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide?
The InChIKey is NEVBYRRRRAEHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4OS/c9-6(13)8-12-11-7(14-8)5-3-1-2-4-10-5/h1-4H,(H2,9,13).
What are the key properties of 5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide?
5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide has a molecular weight of 206.23 g/mol, XLogP of 0.70, 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-thiadiazole-2-carboxamide is sourced from PubChem (CID 159760576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).