5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine

C10H10N4S — CID 103059734

IUPAC5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine
SMILESNc1cnc(CSc2ccccn2)cn1
InChIInChI=1S/C10H10N4S/c11-9-6-13-8(5-14-9)7-15-10-3-1-2-4-12-10/h1-6H,7H2,(H2,11,14)
InChIKeyQTVSFIJUYJFBQP-UHFFFAOYSA-N
MW218.29 g/mol
LogP1.75
Rot. Bonds3

About 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine

5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine (PubChem CID 103059734) has the molecular formula C10H10N4S and a molecular weight of 218.29 g/mol. Its IUPAC name is 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine.

Molecular Properties

Compound Name5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine
PubChem CID103059734
Molecular FormulaC10H10N4S
Molecular Weight218.29 g/mol
Exact Mass218.06
IUPAC Name5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine
SMILESNc1cnc(CSc2ccccn2)cn1
InChIInChI=1S/C10H10N4S/c11-9-6-13-8(5-14-9)7-15-10-3-1-2-4-12-10/h1-6H,7H2,(H2,11,14)
InChIKeyQTVSFIJUYJFBQP-UHFFFAOYSA-N
XLogP1.75
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine?
The IUPAC name of 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine (CID 103059734) is 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine.
What is the SMILES notation for 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine?
The canonical SMILES for 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine is Nc1cnc(CSc2ccccn2)cn1.
What is the InChIKey of 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine?
The InChIKey is QTVSFIJUYJFBQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4S/c11-9-6-13-8(5-14-9)7-15-10-3-1-2-4-12-10/h1-6H,7H2,(H2,11,14).
What are the key properties of 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine?
5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine has a molecular weight of 218.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine is sourced from PubChem (CID 103059734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).