2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine

C69H132N18Si9 — CID 157497142

IUPAC2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)[Si](C)(C)Nc1nc(N[Si](C)(C)C(C)(C)C)nc(N[Si](C)(C)C(C)(C)C)n1.CC[Si](CC)(CC)Nc1nc(N[Si](CC)(CC)CC)nc(N[Si](CC)(CC)CC)n1.C[Si](C)(Nc1nc(N[Si](C)(C)c2ccccc2)nc(N[Si](C)(C)c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C27H36N6Si3.2C21H48N6Si3/c1-34(2,22-16-10-7-11-17-22)31-25-28-26(32-35(3,4)23-18-12-8-13-19-23)30-27(29-25)33-36(5,6)24-20-14-9-15-21-24;1-19(2,3)28(10,11)25-16-22-17(26-29(12,13)20(4,5)6)24-18(23-16)27-30(14,15)21(7,8)9;1-10-28(11-2,12-3)25-19-22-20(26-29(13-4,14-5)15-6)24-21(23-19)27-30(16-7,17-8)18-9/h7-21H,1-6H3,(H3,28,29,30,31,32,33);1-15H3,(H3,22,23,24,25,26,27);10-18H2,1-9H3,(H3,22,23,24,25,26,27)
InChIKeyBXYVOXBIKRZANK-UHFFFAOYSA-N
MW1466.71 g/mol
LogP18.69
Rot. Bonds30

About 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 157497142) has the molecular formula C69H132N18Si9 and a molecular weight of 1466.71 g/mol. Its IUPAC name is 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID157497142
Molecular FormulaC69H132N18Si9
Molecular Weight1466.71 g/mol
Exact Mass1464.88
IUPAC Name2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)[Si](C)(C)Nc1nc(N[Si](C)(C)C(C)(C)C)nc(N[Si](C)(C)C(C)(C)C)n1.CC[Si](CC)(CC)Nc1nc(N[Si](CC)(CC)CC)nc(N[Si](CC)(CC)CC)n1.C[Si](C)(Nc1nc(N[Si](C)(C)c2ccccc2)nc(N[Si](C)(C)c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C27H36N6Si3.2C21H48N6Si3/c1-34(2,22-16-10-7-11-17-22)31-25-28-26(32-35(3,4)23-18-12-8-13-19-23)30-27(29-25)33-36(5,6)24-20-14-9-15-21-24;1-19(2,3)28(10,11)25-16-22-17(26-29(12,13)20(4,5)6)24-18(23-16)27-30(14,15)21(7,8)9;1-10-28(11-2,12-3)25-19-22-20(26-29(13-4,14-5)15-6)24-21(23-19)27-30(16-7,17-8)18-9/h7-21H,1-6H3,(H3,28,29,30,31,32,33);1-15H3,(H3,22,23,24,25,26,27);10-18H2,1-9H3,(H3,22,23,24,25,26,27)
InChIKeyBXYVOXBIKRZANK-UHFFFAOYSA-N
XLogP18.69
TPSA224.28 Ų
H-Bond Donors9
H-Bond Acceptors18
Rotatable Bonds30
Heavy Atoms96
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001466.71
LogP ≤ 518.69
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine (CID 157497142) is 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine is CC(C)(C)[Si](C)(C)Nc1nc(N[Si](C)(C)C(C)(C)C)nc(N[Si](C)(C)C(C)(C)C)n1.CC[Si](CC)(CC)Nc1nc(N[Si](CC)(CC)CC)nc(N[Si](CC)(CC)CC)n1.C[Si](C)(Nc1nc(N[Si](C)(C)c2ccccc2)nc(N[Si](C)(C)c2ccccc2)n1)c1ccccc1.
What is the InChIKey of 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is BXYVOXBIKRZANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H36N6Si3.2C21H48N6Si3/c1-34(2,22-16-10-7-11-17-22)31-25-28-26(32-35(3,4)23-18-12-8-13-19-23)30-27(29-25)33-36(5,6)24-20-14-9-15-21-24;1-19(2,3)28(10,11)25-16-22-17(26-29(12,13)20(4,5)6)24-18(23-16)27-30(14,15)21(7,8)9;1-10-28(11-2,12-3)25-19-22-20(26-29(13-4,14-5)15-6)24-21(23-19)27-30(16-7,17-8)18-9/h7-21H,1-6H3,(H3,28,29,30,31,32,33);1-15H3,(H3,22,23,24,25,26,27);10-18H2,1-9H3,(H3,22,23,24,25,26,27).
What are the key properties of 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1466.71 g/mol, XLogP of 18.69, 30 rotatable bonds, 9 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,6-N-tris[tert-butyl(dimethyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris[dimethyl(phenyl)silyl]-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tris(triethylsilyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 157497142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).