4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine

C11H16N8 — CID 113467607

IUPAC4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine
SMILESCC1CC(Nc2nc(NN)nc(-n3ccnc3)n2)C1
InChIInChI=1S/C11H16N8/c1-7-4-8(5-7)14-9-15-10(18-12)17-11(16-9)19-3-2-13-6-19/h2-3,6-8H,4-5,12H2,1H3,(H2,14,15,16,17,18)
InChIKeyJRTCCPPXSXAFPD-UHFFFAOYSA-N
MW260.31 g/mol
LogP0.55
Rot. Bonds4

About 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine

4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine (PubChem CID 113467607) has the molecular formula C11H16N8 and a molecular weight of 260.31 g/mol. Its IUPAC name is 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine
PubChem CID113467607
Molecular FormulaC11H16N8
Molecular Weight260.31 g/mol
Exact Mass260.15
IUPAC Name4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine
SMILESCC1CC(Nc2nc(NN)nc(-n3ccnc3)n2)C1
InChIInChI=1S/C11H16N8/c1-7-4-8(5-7)14-9-15-10(18-12)17-11(16-9)19-3-2-13-6-19/h2-3,6-8H,4-5,12H2,1H3,(H2,14,15,16,17,18)
InChIKeyJRTCCPPXSXAFPD-UHFFFAOYSA-N
XLogP0.55
TPSA106.57 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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

4-hydrazinyl-6-imidazol-1-yl-N-(4-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 80938412
N-cyclobutyl-4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80918567
4-hydrazinyl-6-imidazol-1-yl-N-[(2-methylcyclopropyl)methyl]-1,3,5-triazin-2-amine
CID 113464289
3-[[4-imidazol-1-yl-6-(methylamino)-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol
CID 80855550
2-(4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine
CID 83027475
4-hydrazinyl-6-imidazol-1-yl-N-methyl-N-[(2-methylcyclopropyl)methyl]-1,3,5-triazin-2-amine
CID 80912687
[4-imidazol-1-yl-6-(3-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80927857
4-hydrazinyl-6-imidazol-1-yl-N-(2-methylphenyl)-1,3,5-triazin-2-amine
CID 80912665
N-(cyclopropylmethyl)-N-ethyl-4-hydrazinyl-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80912708
4-hydrazinyl-6-imidazol-1-yl-N,N-dipropyl-1,3,5-triazin-2-amine
CID 80931860
[4-imidazol-1-yl-6-(2-methylcyclohexyl)oxy-1,3,5-triazin-2-yl]hydrazine
CID 80907359
N-(cyclopropylmethyl)-4-hydrazinyl-6-imidazol-1-yl-N-propyl-1,3,5-triazin-2-amine
CID 80900414

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine (CID 113467607) is 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine is CC1CC(Nc2nc(NN)nc(-n3ccnc3)n2)C1.
What is the InChIKey of 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine?
The InChIKey is JRTCCPPXSXAFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N8/c1-7-4-8(5-7)14-9-15-10(18-12)17-11(16-9)19-3-2-13-6-19/h2-3,6-8H,4-5,12H2,1H3,(H2,14,15,16,17,18).
What are the key properties of 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine?
4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine has a molecular weight of 260.31 g/mol, XLogP of 0.55, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-6-imidazol-1-yl-N-(3-methylcyclobutyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 113467607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).