4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine

C9H14N8 — CID 80900827

IUPAC4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine
SMILESCc1cnn(-c2nc(NN)nc(N(C)C)n2)c1
InChIInChI=1S/C9H14N8/c1-6-4-11-17(5-6)9-13-7(15-10)12-8(14-9)16(2)3/h4-5H,10H2,1-3H3,(H,12,13,14,15)
InChIKeyYSJIENIFGOTMBT-UHFFFAOYSA-N
MW234.27 g/mol
LogP-0.28
Rot. Bonds3

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

4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine (PubChem CID 80900827) has the molecular formula C9H14N8 and a molecular weight of 234.27 g/mol. Its IUPAC name is 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine
PubChem CID80900827
Molecular FormulaC9H14N8
Molecular Weight234.27 g/mol
Exact Mass234.13
IUPAC Name4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine
SMILESCc1cnn(-c2nc(NN)nc(N(C)C)n2)c1
InChIInChI=1S/C9H14N8/c1-6-4-11-17(5-6)9-13-7(15-10)12-8(14-9)16(2)3/h4-5H,10H2,1-3H3,(H,12,13,14,15)
InChIKeyYSJIENIFGOTMBT-UHFFFAOYSA-N
XLogP-0.28
TPSA97.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine (CID 80900827) is 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine is Cc1cnn(-c2nc(NN)nc(N(C)C)n2)c1.
What is the InChIKey of 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine?
The InChIKey is YSJIENIFGOTMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N8/c1-6-4-11-17(5-6)9-13-7(15-10)12-8(14-9)16(2)3/h4-5H,10H2,1-3H3,(H,12,13,14,15).
What are the key properties of 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine?
4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine has a molecular weight of 234.27 g/mol, XLogP of -0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N,N-dimethyl-6-(4-methylpyrazol-1-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80900827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).