2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine

C8H8N6O2 — CID 172788386

IUPAC2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine
SMILESCOc1nc(OC)nc(-c2ncncn2)n1
InChIInChI=1S/C8H8N6O2/c1-15-7-12-6(13-8(14-7)16-2)5-10-3-9-4-11-5/h3-4H,1-2H3
InChIKeyPFKASLZZJVYGGC-UHFFFAOYSA-N
MW220.19 g/mol
LogP-0.26
Rot. Bonds3

About 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine

2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine (PubChem CID 172788386) has the molecular formula C8H8N6O2 and a molecular weight of 220.19 g/mol. Its IUPAC name is 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine
PubChem CID172788386
Molecular FormulaC8H8N6O2
Molecular Weight220.19 g/mol
Exact Mass220.07
IUPAC Name2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine
SMILESCOc1nc(OC)nc(-c2ncncn2)n1
InChIInChI=1S/C8H8N6O2/c1-15-7-12-6(13-8(14-7)16-2)5-10-3-9-4-11-5/h3-4H,1-2H3
InChIKeyPFKASLZZJVYGGC-UHFFFAOYSA-N
XLogP-0.26
TPSA95.80 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 5-0.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine?
The IUPAC name of 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine (CID 172788386) is 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine is COc1nc(OC)nc(-c2ncncn2)n1.
What is the InChIKey of 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine?
The InChIKey is PFKASLZZJVYGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N6O2/c1-15-7-12-6(13-8(14-7)16-2)5-10-3-9-4-11-5/h3-4H,1-2H3.
What are the key properties of 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine?
2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine has a molecular weight of 220.19 g/mol, XLogP of -0.26, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-6-(1,3,5-triazin-2-yl)-1,3,5-triazine is sourced from PubChem (CID 172788386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).