triazolo[5,1-c][1,2,4]triazine

C4H3N5 — CID 90245641

IUPACtriazolo[5,1-c][1,2,4]triazine
SMILESc1cn2nncc2nn1
InChIInChI=1S/C4H3N5/c1-2-9-4(7-5-1)3-6-8-9/h1-3H
InChIKeyXUSLWYMNMLZLCH-UHFFFAOYSA-N
MW121.10 g/mol
LogP-0.48
Rot. Bonds

About triazolo[5,1-c][1,2,4]triazine

triazolo[5,1-c][1,2,4]triazine (PubChem CID 90245641) has the molecular formula C4H3N5 and a molecular weight of 121.10 g/mol. Its IUPAC name is triazolo[5,1-c][1,2,4]triazine.

Molecular Properties

Compound Nametriazolo[5,1-c][1,2,4]triazine
PubChem CID90245641
Molecular FormulaC4H3N5
Molecular Weight121.10 g/mol
Exact Mass121.04
IUPAC Nametriazolo[5,1-c][1,2,4]triazine
SMILESc1cn2nncc2nn1
InChIInChI=1S/C4H3N5/c1-2-9-4(7-5-1)3-6-8-9/h1-3H
InChIKeyXUSLWYMNMLZLCH-UHFFFAOYSA-N
XLogP-0.48
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.10
LogP ≤ 5-0.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze triazolo[5,1-c][1,2,4]triazine 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

N,N-dimethylimidazo[5,1-c][1,2,4]triazin-6-amine
CID 134334517
8-methylpyrazolo[5,1-c][1,2,4]triazine
CID 66594997
triazolo[1,5-a]pyrazine-4-carbonitrile
CID 121350823
8,12,13,16,17-pentazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(17),2,4,6,8,10,12,14-octaene
CID 146336922
CID 143951776
CID 143951776
4-methoxyimidazo[1,2-c]triazole
CID 69459986
triazolo[1,5-a]pyridin-4-ol
CID 154022157
5-tert-butyltriazolo[1,5-a]pyridine
CID 58270238
3,5-bis(triazol-1-yl)pyridine
CID 164853015
tetrazolo[1,5-b]pyridazine
CID 548600
2-imidazo[2,1-c][1,2,4]triazin-6-ylpropanoic acid
CID 82402944
triazol-1-ylhydrazine
CID 154372556

Frequently Asked Questions

What is the IUPAC name of triazolo[5,1-c][1,2,4]triazine?
The IUPAC name of triazolo[5,1-c][1,2,4]triazine (CID 90245641) is triazolo[5,1-c][1,2,4]triazine.
What is the SMILES notation for triazolo[5,1-c][1,2,4]triazine?
The canonical SMILES for triazolo[5,1-c][1,2,4]triazine is c1cn2nncc2nn1.
What is the InChIKey of triazolo[5,1-c][1,2,4]triazine?
The InChIKey is XUSLWYMNMLZLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3N5/c1-2-9-4(7-5-1)3-6-8-9/h1-3H.
What are the key properties of triazolo[5,1-c][1,2,4]triazine?
triazolo[5,1-c][1,2,4]triazine has a molecular weight of 121.10 g/mol, XLogP of -0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triazolo[5,1-c][1,2,4]triazine is sourced from PubChem (CID 90245641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).