hydron;2H-triazole

C2H4N3+ — CID 22561876

IUPAChydron;2H-triazole
SMILES[H+].c1cn[nH]n1
InChIInChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)/p+1
InChIKeyQWENRTYMTSOGBR-UHFFFAOYSA-O
MW70.07 g/mol
LogP-0.08
Rot. Bonds

About hydron;2H-triazole

hydron;2H-triazole (PubChem CID 22561876) has the molecular formula C2H4N3+ and a molecular weight of 70.07 g/mol. Its IUPAC name is hydron;2H-triazole.

Molecular Properties

Compound Namehydron;2H-triazole
PubChem CID22561876
Molecular FormulaC2H4N3+
Molecular Weight70.07 g/mol
Exact Mass70.04
IUPAC Namehydron;2H-triazole
SMILES[H+].c1cn[nH]n1
InChIInChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)/p+1
InChIKeyQWENRTYMTSOGBR-UHFFFAOYSA-O
XLogP-0.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50070.07
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydron;2H-triazole?
The IUPAC name of hydron;2H-triazole (CID 22561876) is hydron;2H-triazole.
What is the SMILES notation for hydron;2H-triazole?
The canonical SMILES for hydron;2H-triazole is [H+].c1cn[nH]n1.
What is the InChIKey of hydron;2H-triazole?
The InChIKey is QWENRTYMTSOGBR-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)/p+1.
What are the key properties of hydron;2H-triazole?
hydron;2H-triazole has a molecular weight of 70.07 g/mol, XLogP of -0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2H-triazole is sourced from PubChem (CID 22561876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).