2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine

C18H13N5 — CID 10308407

IUPAC2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine
SMILESc1ccc(-c2cccc(-n3nnc(-c4ccccn4)n3)c2)cc1
InChIInChI=1S/C18H13N5/c1-2-7-14(8-3-1)15-9-6-10-16(13-15)23-21-18(20-22-23)17-11-4-5-12-19-17/h1-13H
InChIKeyNCULSSBWLJWKIQ-UHFFFAOYSA-N
MW299.34 g/mol
LogP3.39
Rot. Bonds3

About 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine

2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine (PubChem CID 10308407) has the molecular formula C18H13N5 and a molecular weight of 299.34 g/mol. Its IUPAC name is 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine.

Molecular Properties

Compound Name2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine
PubChem CID10308407
Molecular FormulaC18H13N5
Molecular Weight299.34 g/mol
Exact Mass299.12
IUPAC Name2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine
SMILESc1ccc(-c2cccc(-n3nnc(-c4ccccn4)n3)c2)cc1
InChIInChI=1S/C18H13N5/c1-2-7-14(8-3-1)15-9-6-10-16(13-15)23-21-18(20-22-23)17-11-4-5-12-19-17/h1-13H
InChIKeyNCULSSBWLJWKIQ-UHFFFAOYSA-N
XLogP3.39
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.34
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine?
The IUPAC name of 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine (CID 10308407) is 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine.
What is the SMILES notation for 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine?
The canonical SMILES for 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine is c1ccc(-c2cccc(-n3nnc(-c4ccccn4)n3)c2)cc1.
What is the InChIKey of 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine?
The InChIKey is NCULSSBWLJWKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5/c1-2-7-14(8-3-1)15-9-6-10-16(13-15)23-21-18(20-22-23)17-11-4-5-12-19-17/h1-13H.
What are the key properties of 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine?
2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine has a molecular weight of 299.34 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-phenylphenyl)tetrazol-5-yl]pyridine is sourced from PubChem (CID 10308407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).