molecular hydrogen;2H-tetrazole;2H-triazole

C3H9N7 — CID 153378769

IUPACmolecular hydrogen;2H-tetrazole;2H-triazole
SMILES[H][H].[H][H].c1cn[nH]n1.c1nn[nH]n1
InChIInChI=1S/C2H3N3.CH2N4.2H2/c2*1-2-4-5-3-1;;/h1-2H,(H,3,4,5);1H,(H,2,3,4,5);2*1H
InChIKeyUZBPKHJJHBURSP-UHFFFAOYSA-N
MW143.15 g/mol
LogP-0.50
Rot. Bonds

About molecular hydrogen;2H-tetrazole;2H-triazole

molecular hydrogen;2H-tetrazole;2H-triazole (PubChem CID 153378769) has the molecular formula C3H9N7 and a molecular weight of 143.15 g/mol. Its IUPAC name is molecular hydrogen;2H-tetrazole;2H-triazole.

Molecular Properties

Compound Namemolecular hydrogen;2H-tetrazole;2H-triazole
PubChem CID153378769
Molecular FormulaC3H9N7
Molecular Weight143.15 g/mol
Exact Mass143.09
IUPAC Namemolecular hydrogen;2H-tetrazole;2H-triazole
SMILES[H][H].[H][H].c1cn[nH]n1.c1nn[nH]n1
InChIInChI=1S/C2H3N3.CH2N4.2H2/c2*1-2-4-5-3-1;;/h1-2H,(H,3,4,5);1H,(H,2,3,4,5);2*1H
InChIKeyUZBPKHJJHBURSP-UHFFFAOYSA-N
XLogP-0.50
TPSA96.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze molecular hydrogen;2H-tetrazole;2H-triazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;2H-tetrazole;2H-triazole?
The IUPAC name of molecular hydrogen;2H-tetrazole;2H-triazole (CID 153378769) is molecular hydrogen;2H-tetrazole;2H-triazole.
What is the SMILES notation for molecular hydrogen;2H-tetrazole;2H-triazole?
The canonical SMILES for molecular hydrogen;2H-tetrazole;2H-triazole is [H][H].[H][H].c1cn[nH]n1.c1nn[nH]n1.
What is the InChIKey of molecular hydrogen;2H-tetrazole;2H-triazole?
The InChIKey is UZBPKHJJHBURSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3N3.CH2N4.2H2/c2*1-2-4-5-3-1;;/h1-2H,(H,3,4,5);1H,(H,2,3,4,5);2*1H.
What are the key properties of molecular hydrogen;2H-tetrazole;2H-triazole?
molecular hydrogen;2H-tetrazole;2H-triazole has a molecular weight of 143.15 g/mol, XLogP of -0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;2H-tetrazole;2H-triazole is sourced from PubChem (CID 153378769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).