N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine

C21H46N4O2Si3 — CID 91697032

IUPACN-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine
SMILESCC(C)(C)[Si](C)(C)Nc1nc(O[Si](C)(C)C(C)(C)C)nc(O[Si](C)(C)C(C)(C)C)n1
InChIInChI=1S/C21H46N4O2Si3/c1-19(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/h1-15H3,(H,22,23,24,25)
InChIKeyBSJKSDNYSKROIA-UHFFFAOYSA-N
MW470.88 g/mol
LogP7.06
Rot. Bonds6

About N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine

N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine (PubChem CID 91697032) has the molecular formula C21H46N4O2Si3 and a molecular weight of 470.88 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine
PubChem CID91697032
Molecular FormulaC21H46N4O2Si3
Molecular Weight470.88 g/mol
Exact Mass470.29
IUPAC NameN-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine
SMILESCC(C)(C)[Si](C)(C)Nc1nc(O[Si](C)(C)C(C)(C)C)nc(O[Si](C)(C)C(C)(C)C)n1
InChIInChI=1S/C21H46N4O2Si3/c1-19(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/h1-15H3,(H,22,23,24,25)
InChIKeyBSJKSDNYSKROIA-UHFFFAOYSA-N
XLogP7.06
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.88
LogP ≤ 57.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine?
The IUPAC name of N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine (CID 91697032) is N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine.
What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine?
The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine is CC(C)(C)[Si](C)(C)Nc1nc(O[Si](C)(C)C(C)(C)C)nc(O[Si](C)(C)C(C)(C)C)n1.
What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine?
The InChIKey is BSJKSDNYSKROIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46N4O2Si3/c1-19(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/h1-15H3,(H,22,23,24,25).
What are the key properties of N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine?
N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine has a molecular weight of 470.88 g/mol, XLogP of 7.06, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethyl)silyl]-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-1,3,5-triazin-2-amine is sourced from PubChem (CID 91697032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).