5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine

C7H7N5S — CID 64536785

IUPAC5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine
SMILESCc1cnc(-c2nc(N)ns2)cn1
InChIInChI=1S/C7H7N5S/c1-4-2-10-5(3-9-4)6-11-7(8)12-13-6/h2-3H,1H3,(H2,8,12)
InChIKeyIOOITKDBTYLQJC-UHFFFAOYSA-N
MW193.24 g/mol
LogP0.89
Rot. Bonds1

About 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine

5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine (PubChem CID 64536785) has the molecular formula C7H7N5S and a molecular weight of 193.24 g/mol. Its IUPAC name is 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine.

Molecular Properties

Compound Name5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine
PubChem CID64536785
Molecular FormulaC7H7N5S
Molecular Weight193.24 g/mol
Exact Mass193.04
IUPAC Name5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine
SMILESCc1cnc(-c2nc(N)ns2)cn1
InChIInChI=1S/C7H7N5S/c1-4-2-10-5(3-9-4)6-11-7(8)12-13-6/h2-3H,1H3,(H2,8,12)
InChIKeyIOOITKDBTYLQJC-UHFFFAOYSA-N
XLogP0.89
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.24
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine?
The IUPAC name of 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine (CID 64536785) is 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine.
What is the SMILES notation for 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine?
The canonical SMILES for 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine is Cc1cnc(-c2nc(N)ns2)cn1.
What is the InChIKey of 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine?
The InChIKey is IOOITKDBTYLQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5S/c1-4-2-10-5(3-9-4)6-11-7(8)12-13-6/h2-3H,1H3,(H2,8,12).
What are the key properties of 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine?
5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine has a molecular weight of 193.24 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methylpyrazin-2-yl)-1,2,4-thiadiazol-3-amine is sourced from PubChem (CID 64536785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).