2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine

C15H30N6 — CID 23459495

IUPAC2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)Nc1nc(N)nc(N(C(C)(C)C)C(C)(C)C)n1
InChIInChI=1S/C15H30N6/c1-13(2,3)20-11-17-10(16)18-12(19-11)21(14(4,5)6)15(7,8)9/h1-9H3,(H3,16,17,18,19,20)
InChIKeyATVQVDIUGFLUMW-UHFFFAOYSA-N
MW294.45 g/mol
LogP3.07
Rot. Bonds2

About 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 23459495) has the molecular formula C15H30N6 and a molecular weight of 294.45 g/mol. Its IUPAC name is 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine
PubChem CID23459495
Molecular FormulaC15H30N6
Molecular Weight294.45 g/mol
Exact Mass294.25
IUPAC Name2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)Nc1nc(N)nc(N(C(C)(C)C)C(C)(C)C)n1
InChIInChI=1S/C15H30N6/c1-13(2,3)20-11-17-10(16)18-12(19-11)21(14(4,5)6)15(7,8)9/h1-9H3,(H3,16,17,18,19,20)
InChIKeyATVQVDIUGFLUMW-UHFFFAOYSA-N
XLogP3.07
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine (CID 23459495) is 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine is CC(C)(C)Nc1nc(N)nc(N(C(C)(C)C)C(C)(C)C)n1.
What is the InChIKey of 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is ATVQVDIUGFLUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6/c1-13(2,3)20-11-17-10(16)18-12(19-11)21(14(4,5)6)15(7,8)9/h1-9H3,(H3,16,17,18,19,20).
What are the key properties of 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 294.45 g/mol, XLogP of 3.07, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 23459495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).