1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole

C20H15FN4 — CID 73052996

IUPAC1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole
SMILESCc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C20H15FN4/c1-14-8-2-3-9-15(14)16-10-4-5-11-17(16)20-22-23-24-25(20)19-13-7-6-12-18(19)21/h2-13H,1H3
InChIKeyJDCLODCYQSMYHC-UHFFFAOYSA-N
MW330.37 g/mol
LogP4.44
Rot. Bonds3

About 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole

1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole (PubChem CID 73052996) has the molecular formula C20H15FN4 and a molecular weight of 330.37 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole.

Molecular Properties

Compound Name1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole
PubChem CID73052996
Molecular FormulaC20H15FN4
Molecular Weight330.37 g/mol
Exact Mass330.13
IUPAC Name1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole
SMILESCc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F
InChIInChI=1S/C20H15FN4/c1-14-8-2-3-9-15(14)16-10-4-5-11-17(16)20-22-23-24-25(20)19-13-7-6-12-18(19)21/h2-13H,1H3
InChIKeyJDCLODCYQSMYHC-UHFFFAOYSA-N
XLogP4.44
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole?
The IUPAC name of 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole (CID 73052996) is 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole.
What is the SMILES notation for 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole?
The canonical SMILES for 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole is Cc1ccccc1-c1ccccc1-c1nnnn1-c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole?
The InChIKey is JDCLODCYQSMYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4/c1-14-8-2-3-9-15(14)16-10-4-5-11-17(16)20-22-23-24-25(20)19-13-7-6-12-18(19)21/h2-13H,1H3.
What are the key properties of 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole?
1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole has a molecular weight of 330.37 g/mol, XLogP of 4.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-5-[2-(2-methylphenyl)phenyl]tetrazole is sourced from PubChem (CID 73052996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).