2,4,6-trimethyl-1,3,5-triazine

C6H9N3 — CID 13208

IUPAC2,4,6-trimethyl-1,3,5-triazine
SMILESCc1nc(C)nc(C)n1
InChIInChI=1S/C6H9N3/c1-4-7-5(2)9-6(3)8-4/h1-3H3
InChIKeyLASVAZQZFYZNPK-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.80
Rot. Bonds

About 2,4,6-trimethyl-1,3,5-triazine

2,4,6-trimethyl-1,3,5-triazine (PubChem CID 13208) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 2,4,6-trimethyl-1,3,5-triazine.

Molecular Properties

Compound Name2,4,6-trimethyl-1,3,5-triazine
PubChem CID13208
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name2,4,6-trimethyl-1,3,5-triazine
SMILESCc1nc(C)nc(C)n1
InChIInChI=1S/C6H9N3/c1-4-7-5(2)9-6(3)8-4/h1-3H3
InChIKeyLASVAZQZFYZNPK-UHFFFAOYSA-N
XLogP0.80
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-1,3,5-triazine?
The IUPAC name of 2,4,6-trimethyl-1,3,5-triazine (CID 13208) is 2,4,6-trimethyl-1,3,5-triazine.
What is the SMILES notation for 2,4,6-trimethyl-1,3,5-triazine?
The canonical SMILES for 2,4,6-trimethyl-1,3,5-triazine is Cc1nc(C)nc(C)n1.
What is the InChIKey of 2,4,6-trimethyl-1,3,5-triazine?
The InChIKey is LASVAZQZFYZNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-4-7-5(2)9-6(3)8-4/h1-3H3.
What are the key properties of 2,4,6-trimethyl-1,3,5-triazine?
2,4,6-trimethyl-1,3,5-triazine has a molecular weight of 123.16 g/mol, XLogP of 0.80, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-1,3,5-triazine is sourced from PubChem (CID 13208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).