5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C12H12N6 — CID 6493508

IUPAC5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cccc(Nc2cc(C)nc3ncnn23)n1
InChIInChI=1S/C12H12N6/c1-8-4-3-5-10(15-8)17-11-6-9(2)16-12-13-7-14-18(11)12/h3-7H,1-2H3,(H,15,17)
InChIKeyURFFHWPAYKLTSY-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.88
Rot. Bonds2

About 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (PubChem CID 6493508) has the molecular formula C12H12N6 and a molecular weight of 240.27 g/mol. Its IUPAC name is 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
PubChem CID6493508
Molecular FormulaC12H12N6
Molecular Weight240.27 g/mol
Exact Mass240.11
IUPAC Name5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cccc(Nc2cc(C)nc3ncnn23)n1
InChIInChI=1S/C12H12N6/c1-8-4-3-5-10(15-8)17-11-6-9(2)16-12-13-7-14-18(11)12/h3-7H,1-2H3,(H,15,17)
InChIKeyURFFHWPAYKLTSY-UHFFFAOYSA-N
XLogP1.88
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (CID 6493508) is 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is Cc1cccc(Nc2cc(C)nc3ncnn23)n1.
What is the InChIKey of 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is URFFHWPAYKLTSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N6/c1-8-4-3-5-10(15-8)17-11-6-9(2)16-12-13-7-14-18(11)12/h3-7H,1-2H3,(H,15,17).
What are the key properties of 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 240.27 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(6-methyl-2-pyridinyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 6493508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).