2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine

C5H8N8S — CID 170854652

IUPAC2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine
SMILESCSc1nc(N)nc2nc(NN)nn12
InChIInChI=1S/C5H8N8S/c1-14-5-9-2(6)8-4-10-3(11-7)12-13(4)5/h7H2,1H3,(H3,6,8,10,11,12)
InChIKeyKTWWXHVEKUNPOG-UHFFFAOYSA-N
MW212.24 g/mol
LogP-0.89
Rot. Bonds2

About 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine

2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine (PubChem CID 170854652) has the molecular formula C5H8N8S and a molecular weight of 212.24 g/mol. Its IUPAC name is 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine.

Molecular Properties

Compound Name2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine
PubChem CID170854652
Molecular FormulaC5H8N8S
Molecular Weight212.24 g/mol
Exact Mass212.06
IUPAC Name2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine
SMILESCSc1nc(N)nc2nc(NN)nn12
InChIInChI=1S/C5H8N8S/c1-14-5-9-2(6)8-4-10-3(11-7)12-13(4)5/h7H2,1H3,(H3,6,8,10,11,12)
InChIKeyKTWWXHVEKUNPOG-UHFFFAOYSA-N
XLogP-0.89
TPSA120.04 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 5-0.89
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'}

Analyze 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine 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

2-hydrazinyl-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine
CID 170854691
1-methyl-5-methylsulfanyl-1,2,4-triazol-3-amine
CID 522820
7-(4-methoxyphenyl)-4-methylsulfanylpyrazolo[1,5-a][1,3,5]triazin-2-amine
CID 11033489
7-methylsulfanylpyrazolo[1,5-c]pyrimidin-5-amine
CID 117273013
4-chloro-6-hydrazinyl-5-methylsulfanylpyrimidin-2-amine
CID 12926760
2-ethyl-5-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
CID 70951796
2-N-cyclopropyl-6-(3-methylsulfanyl-1,2,4-triazol-4-yl)-1,3,5-triazine-2,4-diamine
CID 110190364
6-hydrazinyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
CID 80923240
7-hydrazinyl-5,6-dimethyl-N-(3-methylbutyl)-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 94672114
tris(6-hydrazinyl-1,3,5-triazine-2,4-diamine);phosphoric acid
CID 173004298
5,7-dichloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 97290091
4-(2,2-dimethylhydrazinyl)-6-hydrazinylpyrimidin-2-amine
CID 83027397

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine?
The IUPAC name of 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine (CID 170854652) is 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine.
What is the SMILES notation for 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine?
The canonical SMILES for 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine is CSc1nc(N)nc2nc(NN)nn12.
What is the InChIKey of 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine?
The InChIKey is KTWWXHVEKUNPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N8S/c1-14-5-9-2(6)8-4-10-3(11-7)12-13(4)5/h7H2,1H3,(H3,6,8,10,11,12).
What are the key properties of 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine?
2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine has a molecular weight of 212.24 g/mol, XLogP of -0.89, 2 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-7-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-amine is sourced from PubChem (CID 170854652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).