4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine

C10H11N5S — CID 83084815

IUPAC4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
SMILESCSc1nc(N)nc(-c2cccc(C)n2)n1
InChIInChI=1S/C10H11N5S/c1-6-4-3-5-7(12-6)8-13-9(11)15-10(14-8)16-2/h3-5H,1-2H3,(H2,11,13,14,15)
InChIKeyHJHOWDQKSLLZNG-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.55
Rot. Bonds2

About 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine

4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine (PubChem CID 83084815) has the molecular formula C10H11N5S and a molecular weight of 233.30 g/mol. Its IUPAC name is 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
PubChem CID83084815
Molecular FormulaC10H11N5S
Molecular Weight233.30 g/mol
Exact Mass233.07
IUPAC Name4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine
SMILESCSc1nc(N)nc(-c2cccc(C)n2)n1
InChIInChI=1S/C10H11N5S/c1-6-4-3-5-7(12-6)8-13-9(11)15-10(14-8)16-2/h3-5H,1-2H3,(H2,11,13,14,15)
InChIKeyHJHOWDQKSLLZNG-UHFFFAOYSA-N
XLogP1.55
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine (CID 83084815) is 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine is CSc1nc(N)nc(-c2cccc(C)n2)n1.
What is the InChIKey of 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
The InChIKey is HJHOWDQKSLLZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5S/c1-6-4-3-5-7(12-6)8-13-9(11)15-10(14-8)16-2/h3-5H,1-2H3,(H2,11,13,14,15).
What are the key properties of 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine?
4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine has a molecular weight of 233.30 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-2-pyridinyl)-6-methylsulfanyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 83084815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).