2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine

C7H8N6S — CID 130927636

IUPAC2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine
SMILESNc1cnc(NCc2cnns2)cn1
InChIInChI=1S/C7H8N6S/c8-6-3-11-7(4-9-6)10-1-5-2-12-13-14-5/h2-4H,1H2,(H2,8,9)(H,10,11)
InChIKeyIKWYEQXMGJMXJH-UHFFFAOYSA-N
MW208.25 g/mol
LogP0.52
Rot. Bonds3

About 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine

2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine (PubChem CID 130927636) has the molecular formula C7H8N6S and a molecular weight of 208.25 g/mol. Its IUPAC name is 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine.

Molecular Properties

Compound Name2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine
PubChem CID130927636
Molecular FormulaC7H8N6S
Molecular Weight208.25 g/mol
Exact Mass208.05
IUPAC Name2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine
SMILESNc1cnc(NCc2cnns2)cn1
InChIInChI=1S/C7H8N6S/c8-6-3-11-7(4-9-6)10-1-5-2-12-13-14-5/h2-4H,1H2,(H2,8,9)(H,10,11)
InChIKeyIKWYEQXMGJMXJH-UHFFFAOYSA-N
XLogP0.52
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.25
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine?
The IUPAC name of 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine (CID 130927636) is 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine.
What is the SMILES notation for 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine?
The canonical SMILES for 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine is Nc1cnc(NCc2cnns2)cn1.
What is the InChIKey of 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine?
The InChIKey is IKWYEQXMGJMXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N6S/c8-6-3-11-7(4-9-6)10-1-5-2-12-13-14-5/h2-4H,1H2,(H2,8,9)(H,10,11).
What are the key properties of 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine?
2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine has a molecular weight of 208.25 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(thiadiazol-5-ylmethyl)pyrazine-2,5-diamine is sourced from PubChem (CID 130927636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).