azane;1,1'-biphenyl;2H-triazole

C14H16N4 — CID 70118155

IUPACazane;1,1'-biphenyl;2H-triazole
SMILESN.c1ccc(-c2ccccc2)cc1.c1cn[nH]n1
InChIInChI=1S/C12H10.C2H3N3.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;/h1-10H;1-2H,(H,3,4,5);1H3
InChIKeyFZNPJAUCRNZTIY-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.32
Rot. Bonds1

About azane;1,1'-biphenyl;2H-triazole

azane;1,1'-biphenyl;2H-triazole (PubChem CID 70118155) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is azane;1,1'-biphenyl;2H-triazole.

Molecular Properties

Compound Nameazane;1,1'-biphenyl;2H-triazole
PubChem CID70118155
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Nameazane;1,1'-biphenyl;2H-triazole
SMILESN.c1ccc(-c2ccccc2)cc1.c1cn[nH]n1
InChIInChI=1S/C12H10.C2H3N3.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;/h1-10H;1-2H,(H,3,4,5);1H3
InChIKeyFZNPJAUCRNZTIY-UHFFFAOYSA-N
XLogP3.32
TPSA76.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of azane;1,1'-biphenyl;2H-triazole?
The IUPAC name of azane;1,1'-biphenyl;2H-triazole (CID 70118155) is azane;1,1'-biphenyl;2H-triazole.
What is the SMILES notation for azane;1,1'-biphenyl;2H-triazole?
The canonical SMILES for azane;1,1'-biphenyl;2H-triazole is N.c1ccc(-c2ccccc2)cc1.c1cn[nH]n1.
What is the InChIKey of azane;1,1'-biphenyl;2H-triazole?
The InChIKey is FZNPJAUCRNZTIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10.C2H3N3.H3N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-4-5-3-1;/h1-10H;1-2H,(H,3,4,5);1H3.
What are the key properties of azane;1,1'-biphenyl;2H-triazole?
azane;1,1'-biphenyl;2H-triazole has a molecular weight of 240.31 g/mol, XLogP of 3.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,1'-biphenyl;2H-triazole is sourced from PubChem (CID 70118155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).