4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one

C4H10N6O — CID 101425008

IUPAC4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one
SMILESCC1=NNC(NN)N(N)C1=O
InChIInChI=1S/C4H10N6O/c1-2-3(11)10(6)4(7-5)9-8-2/h4,7,9H,5-6H2,1H3
InChIKeyDUADOPPLTBAOFP-UHFFFAOYSA-N
MW158.17 g/mol
LogP-2.59
Rot. Bonds1

About 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one

4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one (PubChem CID 101425008) has the molecular formula C4H10N6O and a molecular weight of 158.17 g/mol. Its IUPAC name is 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one.

Molecular Properties

Compound Name4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one
PubChem CID101425008
Molecular FormulaC4H10N6O
Molecular Weight158.17 g/mol
Exact Mass158.09
IUPAC Name4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one
SMILESCC1=NNC(NN)N(N)C1=O
InChIInChI=1S/C4H10N6O/c1-2-3(11)10(6)4(7-5)9-8-2/h4,7,9H,5-6H2,1H3
InChIKeyDUADOPPLTBAOFP-UHFFFAOYSA-N
XLogP-2.59
TPSA108.77 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.17
LogP ≤ 5-2.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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'}

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Related Compounds

4-Amino-6-methyl-3-thio-3,4-dihydro-1,2,4-triazin-5(2h)-one
CID 129855836
N-(6-Methyl-3-oxo-2,5-dihydro-1,2,4-triazin-4(3H)-yl)acetamide
CID 11008343
3-amino-6-methyl-3,4-dihydro-2H-1,2,4-triazin-5-one
CID 4994630
4,6-Dimethyl-2,3-dihydro-1,2,4-triazin-5-one
CID 13290902
4-Amino-6-methyl-3-methylthio-2,3-dihydro-1,2,4-triazin-5-one
CID 20788177
(3R)-4-amino-6-methyl-3-methylsulfanyl-2,3-dihydro-1,2,4-triazin-5-one
CID 27235036
(3S)-4-amino-6-methyl-3-methylsulfanyl-2,3-dihydro-1,2,4-triazin-5-one
CID 27235037
7-amino-3-methyl-6,8a-dihydro-1H-[1,2,4]triazolo[5,1-c][1,2,4]triazin-4-one
CID 85965948

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one?
The IUPAC name of 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one (CID 101425008) is 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one.
What is the SMILES notation for 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one?
The canonical SMILES for 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one is CC1=NNC(NN)N(N)C1=O.
What is the InChIKey of 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one?
The InChIKey is DUADOPPLTBAOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N6O/c1-2-3(11)10(6)4(7-5)9-8-2/h4,7,9H,5-6H2,1H3.
What are the key properties of 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one?
4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one has a molecular weight of 158.17 g/mol, XLogP of -2.59, 1 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-hydrazinyl-6-methyl-2,3-dihydro-1,2,4-triazin-5-one is sourced from PubChem (CID 101425008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).