5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide

C8H7N5S2 — CID 115490181

IUPAC5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(Sc2ncns2)cn1
InChIInChI=1S/C8H7N5S2/c9-7(10)6-2-1-5(3-11-6)14-8-12-4-13-15-8/h1-4H,(H3,9,10)
InChIKeyHJCXUZCNLYSQSA-UHFFFAOYSA-N
MW237.31 g/mol
LogP1.37
Rot. Bonds3

About 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide

5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide (PubChem CID 115490181) has the molecular formula C8H7N5S2 and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide.

Molecular Properties

Compound Name5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide
PubChem CID115490181
Molecular FormulaC8H7N5S2
Molecular Weight237.31 g/mol
Exact Mass237.01
IUPAC Name5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(Sc2ncns2)cn1
InChIInChI=1S/C8H7N5S2/c9-7(10)6-2-1-5(3-11-6)14-8-12-4-13-15-8/h1-4H,(H3,9,10)
InChIKeyHJCXUZCNLYSQSA-UHFFFAOYSA-N
XLogP1.37
TPSA88.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

5-(3,5-dichlorophenyl)sulfanylpyridine-2-carboximidamide
CID 112736289
5-(4,6-dimethylpyrimidin-2-yl)sulfanylpyridine-2-carboximidamide
CID 113321389
5-naphthalen-2-ylsulfanylpyridine-2-carboximidamide
CID 115490136
5-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]pyridine-2-carboximidamide
CID 113321384
5-tert-butylsulfanylpyridine-2-carboximidamide
CID 71756587
5-(7H-purin-6-ylsulfanyl)pyridine-2-carboximidamide
CID 115490148
5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-2-carboximidamide
CID 115490183
5-(1-methylimidazol-2-yl)sulfanylpyridine-2-carboximidamide
CID 115490097
4-bromo-2-(1,2,4-thiadiazol-5-ylsulfanyl)benzenecarboximidamide
CID 114905233
5-(oxetan-3-ylsulfanyl)pyridine-2-carboximidamide
CID 115490175
5-(3-hydroxypropylsulfanyl)pyridine-2-carboximidamide
CID 115490174
5-(1H-benzimidazol-2-ylsulfanyl)pyridine-2-carboximidamide
CID 115490107

Frequently Asked Questions

What is the IUPAC name of 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide?
The IUPAC name of 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide (CID 115490181) is 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide.
What is the SMILES notation for 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide?
The canonical SMILES for 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(Sc2ncns2)cn1.
What is the InChIKey of 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide?
The InChIKey is HJCXUZCNLYSQSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N5S2/c9-7(10)6-2-1-5(3-11-6)14-8-12-4-13-15-8/h1-4H,(H3,9,10).
What are the key properties of 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide?
5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide has a molecular weight of 237.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2,4-thiadiazol-5-ylsulfanyl)pyridine-2-carboximidamide is sourced from PubChem (CID 115490181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).