2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine

C17H11N11 — CID 58260771

IUPAC2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine
SMILESc1cc(-c2cccc(-c3nn[nH]n3)n2)nc(-c2cccc(-c3nn[nH]n3)n2)c1
InChIInChI=1S/C17H11N11/c1-4-10(12-6-2-8-14(19-12)16-21-25-26-22-16)18-11(5-1)13-7-3-9-15(20-13)17-23-27-28-24-17/h1-9H,(H,21,22,25,26)(H,23,24,27,28)
InChIKeyBIWUINQRUMQBLQ-UHFFFAOYSA-N
MW369.35 g/mol
LogP1.57
Rot. Bonds4

About 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine

2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine (PubChem CID 58260771) has the molecular formula C17H11N11 and a molecular weight of 369.35 g/mol. Its IUPAC name is 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine
PubChem CID58260771
Molecular FormulaC17H11N11
Molecular Weight369.35 g/mol
Exact Mass369.12
IUPAC Name2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine
SMILESc1cc(-c2cccc(-c3nn[nH]n3)n2)nc(-c2cccc(-c3nn[nH]n3)n2)c1
InChIInChI=1S/C17H11N11/c1-4-10(12-6-2-8-14(19-12)16-21-25-26-22-16)18-11(5-1)13-7-3-9-15(20-13)17-23-27-28-24-17/h1-9H,(H,21,22,25,26)(H,23,24,27,28)
InChIKeyBIWUINQRUMQBLQ-UHFFFAOYSA-N
XLogP1.57
TPSA147.59 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.35
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine?
The IUPAC name of 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine (CID 58260771) is 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine.
What is the SMILES notation for 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine?
The canonical SMILES for 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine is c1cc(-c2cccc(-c3nn[nH]n3)n2)nc(-c2cccc(-c3nn[nH]n3)n2)c1.
What is the InChIKey of 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine?
The InChIKey is BIWUINQRUMQBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N11/c1-4-10(12-6-2-8-14(19-12)16-21-25-26-22-16)18-11(5-1)13-7-3-9-15(20-13)17-23-27-28-24-17/h1-9H,(H,21,22,25,26)(H,23,24,27,28).
What are the key properties of 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine?
2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine has a molecular weight of 369.35 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[6-(2H-tetrazol-5-yl)-2-pyridinyl]pyridine is sourced from PubChem (CID 58260771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).