2,4,6-tributyl-1,3,5-triazinane

C15H33N3 — CID 12508643

IUPAC2,4,6-tributyl-1,3,5-triazinane
SMILESCCCCC1NC(CCCC)NC(CCCC)N1
InChIInChI=1S/C15H33N3/c1-4-7-10-13-16-14(11-8-5-2)18-15(17-13)12-9-6-3/h13-18H,4-12H2,1-3H3
InChIKeyAZGFJSHXPXAAGJ-UHFFFAOYSA-N
MW255.45 g/mol
LogP3.32
Rot. Bonds9

About 2,4,6-tributyl-1,3,5-triazinane

2,4,6-tributyl-1,3,5-triazinane (PubChem CID 12508643) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is 2,4,6-tributyl-1,3,5-triazinane.

Molecular Properties

Compound Name2,4,6-tributyl-1,3,5-triazinane
PubChem CID12508643
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC Name2,4,6-tributyl-1,3,5-triazinane
SMILESCCCCC1NC(CCCC)NC(CCCC)N1
InChIInChI=1S/C15H33N3/c1-4-7-10-13-16-14(11-8-5-2)18-15(17-13)12-9-6-3/h13-18H,4-12H2,1-3H3
InChIKeyAZGFJSHXPXAAGJ-UHFFFAOYSA-N
XLogP3.32
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 53.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-tributyl-1,3,5-triazinane?
The IUPAC name of 2,4,6-tributyl-1,3,5-triazinane (CID 12508643) is 2,4,6-tributyl-1,3,5-triazinane.
What is the SMILES notation for 2,4,6-tributyl-1,3,5-triazinane?
The canonical SMILES for 2,4,6-tributyl-1,3,5-triazinane is CCCCC1NC(CCCC)NC(CCCC)N1.
What is the InChIKey of 2,4,6-tributyl-1,3,5-triazinane?
The InChIKey is AZGFJSHXPXAAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-4-7-10-13-16-14(11-8-5-2)18-15(17-13)12-9-6-3/h13-18H,4-12H2,1-3H3.
What are the key properties of 2,4,6-tributyl-1,3,5-triazinane?
2,4,6-tributyl-1,3,5-triazinane has a molecular weight of 255.45 g/mol, XLogP of 3.32, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tributyl-1,3,5-triazinane is sourced from PubChem (CID 12508643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).