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

C11H22N6 — CID 20532626

IUPAC2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)Nc1nc(N)nc(NC(C)(C)C)n1
InChIInChI=1S/C11H22N6/c1-10(2,3)16-8-13-7(12)14-9(15-8)17-11(4,5)6/h1-6H3,(H4,12,13,14,15,16,17)
InChIKeyQODDZJVKOZSTRK-UHFFFAOYSA-N
MW238.34 g/mol
LogP1.87
Rot. Bonds2

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

2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 20532626) has the molecular formula C11H22N6 and a molecular weight of 238.34 g/mol. Its IUPAC name is 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine
PubChem CID20532626
Molecular FormulaC11H22N6
Molecular Weight238.34 g/mol
Exact Mass238.19
IUPAC Name2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)(C)Nc1nc(N)nc(NC(C)(C)C)n1
InChIInChI=1S/C11H22N6/c1-10(2,3)16-8-13-7(12)14-9(15-8)17-11(4,5)6/h1-6H3,(H4,12,13,14,15,16,17)
InChIKeyQODDZJVKOZSTRK-UHFFFAOYSA-N
XLogP1.87
TPSA88.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 51.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

Terbuthylazine
CID 22206
Terbumeton
CID 36584
Desethylterbuthylazine
CID 108201
1,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-bis(1,1-dimethylethyl)-
CID 604080
4-N,6-N-ditert-butyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 744450
1,3,5-Triazine, 2-tert-butylamino-4-chloro-6-propylamino-
CID 615138
2-Amino-4-tert-butylamino-6-methoxy-1,3,5-triazine
CID 185719
4-(Tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl(ethyl)cyanamide
CID 3128115
N-tert-Butyl-6-chloro-N'-methyl-[1,3,5]triazine-2,4-diamine
CID 36755
(4-tert-Butylamino-6-ethylamino-[1,3,5]triazin-2-yl)-ethyl-cyanamide
CID 652999
N2,N4-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
CID 748920
N2-tert-butyl-N6-ethyl-N4-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 1119846

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine (CID 20532626) is 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine is CC(C)(C)Nc1nc(N)nc(NC(C)(C)C)n1.
What is the InChIKey of 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is QODDZJVKOZSTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6/c1-10(2,3)16-8-13-7(12)14-9(15-8)17-11(4,5)6/h1-6H3,(H4,12,13,14,15,16,17).
What are the key properties of 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 238.34 g/mol, XLogP of 1.87, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-ditert-butyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 20532626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).