4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide

C4H9N9O — CID 178071062

IUPAC4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide
SMILESNNC(=O)c1nc(NN)nc(NN)n1
InChIInChI=1S/C4H9N9O/c5-11-2(14)1-8-3(12-6)10-4(9-1)13-7/h5-7H2,(H,11,14)(H2,8,9,10,12,13)
InChIKeyGZQDVZQELOJYPV-UHFFFAOYSA-N
MW199.18 g/mol
LogP-2.95
Rot. Bonds3

About 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide

4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide (PubChem CID 178071062) has the molecular formula C4H9N9O and a molecular weight of 199.18 g/mol. Its IUPAC name is 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide.

Molecular Properties

Compound Name4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide
PubChem CID178071062
Molecular FormulaC4H9N9O
Molecular Weight199.18 g/mol
Exact Mass199.09
IUPAC Name4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide
SMILESNNC(=O)c1nc(NN)nc(NN)n1
InChIInChI=1S/C4H9N9O/c5-11-2(14)1-8-3(12-6)10-4(9-1)13-7/h5-7H2,(H,11,14)(H2,8,9,10,12,13)
InChIKeyGZQDVZQELOJYPV-UHFFFAOYSA-N
XLogP-2.95
TPSA169.89 Ų
H-Bond Donors6
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500199.18
LogP ≤ 5-2.95
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,6-Bis(dimethylamino)-1,3,5-triazine-2-carbohydrazide
CID 602539
4,6-Diamino-1,3,5-triazine-2-carbohydrazide
CID 146317078
4-Amino-6-ethoxy-1,3,5-triazine-2-carbohydrazide
CID 588381
1,3,5-Triazine-2-carbohydrazide
CID 21537408
1,3,5-Triazine-2,4,6-tricarbohydrazide
CID 68618307

Frequently Asked Questions

What is the IUPAC name of 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide?
The IUPAC name of 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide (CID 178071062) is 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide.
What is the SMILES notation for 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide?
The canonical SMILES for 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide is NNC(=O)c1nc(NN)nc(NN)n1.
What is the InChIKey of 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide?
The InChIKey is GZQDVZQELOJYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N9O/c5-11-2(14)1-8-3(12-6)10-4(9-1)13-7/h5-7H2,(H,11,14)(H2,8,9,10,12,13).
What are the key properties of 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide?
4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide has a molecular weight of 199.18 g/mol, XLogP of -2.95, 3 rotatable bonds, 6 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dihydrazinyl-1,3,5-triazine-2-carbohydrazide is sourced from PubChem (CID 178071062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).