5-(2-phenylphenyl)-2H-tetrazole

C13H10N4 — CID 15207492

IUPAC5-(2-phenylphenyl)-2H-tetrazole
SMILESc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
InChIInChI=1S/C13H10N4/c1-2-6-10(7-3-1)11-8-4-5-9-12(11)13-14-16-17-15-13/h1-9H,(H,14,15,16,17)
InChIKeyHLAYLOOJBAJIRU-UHFFFAOYSA-N
MW222.25 g/mol
LogP2.53
Rot. Bonds2

About 5-(2-phenylphenyl)-2H-tetrazole

5-(2-phenylphenyl)-2H-tetrazole (PubChem CID 15207492) has the molecular formula C13H10N4 and a molecular weight of 222.25 g/mol. Its IUPAC name is 5-(2-phenylphenyl)-2H-tetrazole.

Molecular Properties

Compound Name5-(2-phenylphenyl)-2H-tetrazole
PubChem CID15207492
Molecular FormulaC13H10N4
Molecular Weight222.25 g/mol
Exact Mass222.09
IUPAC Name5-(2-phenylphenyl)-2H-tetrazole
SMILESc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
InChIInChI=1S/C13H10N4/c1-2-6-10(7-3-1)11-8-4-5-9-12(11)13-14-16-17-15-13/h1-9H,(H,14,15,16,17)
InChIKeyHLAYLOOJBAJIRU-UHFFFAOYSA-N
XLogP2.53
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Phenyl-1H-tetrazole
CID 87425
5-[3-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetrazole
CID 706933
5-(4-Methylphenyl)-1H-tetrazole
CID 285164
5-[4-(Trifluoromethyl)phenyl]-1H-tetrazole
CID 342565
5-(3-fluorophenyl)-2H-1,2,3,4-tetrazole
CID 333943
5-(2-methylphenyl)-2H-1,2,3,4-tetrazole
CID 583067
5,5'-(1,2-Phenylene)bis-1H-tetrazole
CID 788681
5-(4'-Methyl-1,1'-biphenyl-2-yl)-1H-tetrazole
CID 9794697
5-(m-Tolyl)-1H-tetrazole
CID 583308
5-(2-fluorophenyl)-1H-1,2,3,4-tetrazole
CID 596275
5-(4-Fluorophenyl)-1H-tetrazole
CID 766140
5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)
CID 4058493

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenylphenyl)-2H-tetrazole?
The IUPAC name of 5-(2-phenylphenyl)-2H-tetrazole (CID 15207492) is 5-(2-phenylphenyl)-2H-tetrazole.
What is the SMILES notation for 5-(2-phenylphenyl)-2H-tetrazole?
The canonical SMILES for 5-(2-phenylphenyl)-2H-tetrazole is c1ccc(-c2ccccc2-c2nn[nH]n2)cc1.
What is the InChIKey of 5-(2-phenylphenyl)-2H-tetrazole?
The InChIKey is HLAYLOOJBAJIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4/c1-2-6-10(7-3-1)11-8-4-5-9-12(11)13-14-16-17-15-13/h1-9H,(H,14,15,16,17).
What are the key properties of 5-(2-phenylphenyl)-2H-tetrazole?
5-(2-phenylphenyl)-2H-tetrazole has a molecular weight of 222.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenylphenyl)-2H-tetrazole is sourced from PubChem (CID 15207492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).