2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine

C19H14N6 — CID 58261693

IUPAC2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
SMILESCc1ccc(-c2nc(-c3ccccn3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C19H14N6/c1-13-8-9-16(22-12-13)19-24-17(14-6-2-4-10-20-14)23-18(25-19)15-7-3-5-11-21-15/h2-12H,1H3
InChIKeyGSIVNMVBARBKFX-UHFFFAOYSA-N
MW326.36 g/mol
LogP3.37
Rot. Bonds3

About 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine

2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine (PubChem CID 58261693) has the molecular formula C19H14N6 and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
PubChem CID58261693
Molecular FormulaC19H14N6
Molecular Weight326.36 g/mol
Exact Mass326.13
IUPAC Name2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
SMILESCc1ccc(-c2nc(-c3ccccn3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C19H14N6/c1-13-8-9-16(22-12-13)19-24-17(14-6-2-4-10-20-14)23-18(25-19)15-7-3-5-11-21-15/h2-12H,1H3
InChIKeyGSIVNMVBARBKFX-UHFFFAOYSA-N
XLogP3.37
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine?
The IUPAC name of 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine (CID 58261693) is 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine.
What is the SMILES notation for 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine?
The canonical SMILES for 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine is Cc1ccc(-c2nc(-c3ccccn3)nc(-c3ccccn3)n2)nc1.
What is the InChIKey of 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine?
The InChIKey is GSIVNMVBARBKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6/c1-13-8-9-16(22-12-13)19-24-17(14-6-2-4-10-20-14)23-18(25-19)15-7-3-5-11-21-15/h2-12H,1H3.
What are the key properties of 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine?
2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine has a molecular weight of 326.36 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine is sourced from PubChem (CID 58261693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).