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

C11H23N7 — CID 748920

IUPAC2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
SMILESCC(C)(C)Nc1nc(NN)nc(NC(C)(C)C)n1
InChIInChI=1S/C11H23N7/c1-10(2,3)16-7-13-8(17-11(4,5)6)15-9(14-7)18-12/h12H2,1-6H3,(H3,13,14,15,16,17,18)
InChIKeyYWVAFGKAVNYSSZ-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.58
Rot. Bonds3

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

2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine (PubChem CID 748920) has the molecular formula C11H23N7 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
PubChem CID748920
Molecular FormulaC11H23N7
Molecular Weight253.35 g/mol
Exact Mass253.20
IUPAC Name2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
SMILESCC(C)(C)Nc1nc(NN)nc(NC(C)(C)C)n1
InChIInChI=1S/C11H23N7/c1-10(2,3)16-7-13-8(17-11(4,5)6)15-9(14-7)18-12/h12H2,1-6H3,(H3,13,14,15,16,17,18)
InChIKeyYWVAFGKAVNYSSZ-UHFFFAOYSA-N
XLogP1.58
TPSA100.78 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-bis(1,1-dimethylethyl)-
CID 604080
N,N'-di-(t-butyl)melamine
CID 20532626
N,N',N''-Tris(tert-butyl)-1,3,5-triazine-2,4,6-triamine
CID 85354
1-[4,6-Bis(2-tert-butylhydrazinyl)-1,3,5-triazin-2-yl]-2-tert-butylhydrazine
CID 23344775
2-N,2-N,4-N-tritert-butyl-1,3,5-triazine-2,4,6-triamine
CID 23459495
6-[2-(2,3,3-Trimethylbutan-2-yl)hydrazinyl]-1,3,5-triazine-2,4-diamine
CID 70612494
6-(2-methylhydrazinyl)-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
CID 70635023
N-tert-butyl-4,6-dihydrazinyl-1,3,5-triazin-2-amine
CID 134416295
6-hydrazinyl-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 139328012
2-N,4-N-bis(2-methylpropyl)-6-(2-propan-2-ylhydrazinyl)-1,3,5-triazine-2,4-diamine
CID 158875009
2-N,4-N-ditert-butyl-6-[methyl(methylamino)amino]-1,3,5-triazine-2,4-diamine
CID 177727362
4-(2-Tert-butylhydrazinyl)-6-chloro-1,3,5-triazin-2-amine
CID 178081936

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine (CID 748920) is 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine is CC(C)(C)Nc1nc(NN)nc(NC(C)(C)C)n1.
What is the InChIKey of 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The InChIKey is YWVAFGKAVNYSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N7/c1-10(2,3)16-7-13-8(17-11(4,5)6)15-9(14-7)18-12/h12H2,1-6H3,(H3,13,14,15,16,17,18).
What are the key properties of 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine has a molecular weight of 253.35 g/mol, XLogP of 1.58, 3 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-ditert-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 748920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).