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

C6H11N3 — CID 54346863

IUPAC1,4,6-trimethyl-2H-1,3,5-triazine
SMILESCC1=NCN(C)C(C)=N1
InChIInChI=1S/C6H11N3/c1-5-7-4-9(3)6(2)8-5/h4H2,1-3H3
InChIKeyUCXDRYBPQRODDY-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.73
Rot. Bonds

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

1,4,6-trimethyl-2H-1,3,5-triazine (PubChem CID 54346863) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 1,4,6-trimethyl-2H-1,3,5-triazine.

Molecular Properties

Compound Name1,4,6-trimethyl-2H-1,3,5-triazine
PubChem CID54346863
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name1,4,6-trimethyl-2H-1,3,5-triazine
SMILESCC1=NCN(C)C(C)=N1
InChIInChI=1S/C6H11N3/c1-5-7-4-9(3)6(2)8-5/h4H2,1-3H3
InChIKeyUCXDRYBPQRODDY-UHFFFAOYSA-N
XLogP0.73
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4,6-trimethyl-2H-1,3,5-triazine?
The IUPAC name of 1,4,6-trimethyl-2H-1,3,5-triazine (CID 54346863) is 1,4,6-trimethyl-2H-1,3,5-triazine.
What is the SMILES notation for 1,4,6-trimethyl-2H-1,3,5-triazine?
The canonical SMILES for 1,4,6-trimethyl-2H-1,3,5-triazine is CC1=NCN(C)C(C)=N1.
What is the InChIKey of 1,4,6-trimethyl-2H-1,3,5-triazine?
The InChIKey is UCXDRYBPQRODDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-5-7-4-9(3)6(2)8-5/h4H2,1-3H3.
What are the key properties of 1,4,6-trimethyl-2H-1,3,5-triazine?
1,4,6-trimethyl-2H-1,3,5-triazine has a molecular weight of 125.17 g/mol, XLogP of 0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6-trimethyl-2H-1,3,5-triazine is sourced from PubChem (CID 54346863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).