2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine

C8H13N9 — CID 83027475

IUPAC2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine
SMILESCN(C)Nc1nc(NN)nc(-n2ccnc2)n1
InChIInChI=1S/C8H13N9/c1-16(2)15-7-11-6(14-9)12-8(13-7)17-4-3-10-5-17/h3-5H,9H2,1-2H3,(H2,11,12,13,14,15)
InChIKeyWFOUSCALAVHFCD-UHFFFAOYSA-N
MW235.25 g/mol
LogP-0.77
Rot. Bonds4

About 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine

2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine (PubChem CID 83027475) has the molecular formula C8H13N9 and a molecular weight of 235.25 g/mol. Its IUPAC name is 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine
PubChem CID83027475
Molecular FormulaC8H13N9
Molecular Weight235.25 g/mol
Exact Mass235.13
IUPAC Name2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine
SMILESCN(C)Nc1nc(NN)nc(-n2ccnc2)n1
InChIInChI=1S/C8H13N9/c1-16(2)15-7-11-6(14-9)12-8(13-7)17-4-3-10-5-17/h3-5H,9H2,1-2H3,(H2,11,12,13,14,15)
InChIKeyWFOUSCALAVHFCD-UHFFFAOYSA-N
XLogP-0.77
TPSA109.81 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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

N'-ethyl-N-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-N'-methylethane-1,2-diamine
CID 80919698
3-[(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]propan-1-ol
CID 80944977
4-hydrazinyl-6-imidazol-1-yl-N,N-dipropyl-1,3,5-triazin-2-amine
CID 80931860
4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine
CID 113467607
4-hydrazinyl-6-imidazol-1-yl-N-methyl-N-[(2-methylcyclopropyl)methyl]-1,3,5-triazin-2-amine
CID 80912687
N-cyclobutyl-4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80918567
N-benzyl-4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80911395
4-hydrazinyl-6-imidazol-1-yl-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80943000
1-[(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)oxy]-N,N,2-trimethylpropan-2-amine
CID 80925355
4-hydrazinyl-6-imidazol-1-yl-N-(2-methylphenyl)-1,3,5-triazin-2-amine
CID 80912665
4-hydrazinyl-6-imidazol-1-yl-N-(4-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 80938412
1-[(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)amino]-2-methylbutan-2-ol
CID 80914978

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine?
The IUPAC name of 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine (CID 83027475) is 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine.
What is the SMILES notation for 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine?
The canonical SMILES for 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine is CN(C)Nc1nc(NN)nc(-n2ccnc2)n1.
What is the InChIKey of 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine?
The InChIKey is WFOUSCALAVHFCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N9/c1-16(2)15-7-11-6(14-9)12-8(13-7)17-4-3-10-5-17/h3-5H,9H2,1-2H3,(H2,11,12,13,14,15).
What are the key properties of 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine?
2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine has a molecular weight of 235.25 g/mol, XLogP of -0.77, 4 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine is sourced from PubChem (CID 83027475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).