2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine

C13H11N5 — CID 152755489

IUPAC2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine
SMILESCc1ccc(-c2nnnn2-c2ccccn2)cc1
InChIInChI=1S/C13H11N5/c1-10-5-7-11(8-6-10)13-15-16-17-18(13)12-4-2-3-9-14-12/h2-9H,1H3
InChIKeyGLSSKCBDIAWLMF-UHFFFAOYSA-N
MW237.27 g/mol
LogP2.03
Rot. Bonds2

About 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine

2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine (PubChem CID 152755489) has the molecular formula C13H11N5 and a molecular weight of 237.27 g/mol. Its IUPAC name is 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine.

Molecular Properties

Compound Name2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine
PubChem CID152755489
Molecular FormulaC13H11N5
Molecular Weight237.27 g/mol
Exact Mass237.10
IUPAC Name2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine
SMILESCc1ccc(-c2nnnn2-c2ccccn2)cc1
InChIInChI=1S/C13H11N5/c1-10-5-7-11(8-6-10)13-15-16-17-18(13)12-4-2-3-9-14-12/h2-9H,1H3
InChIKeyGLSSKCBDIAWLMF-UHFFFAOYSA-N
XLogP2.03
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine?
The IUPAC name of 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine (CID 152755489) is 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine.
What is the SMILES notation for 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine?
The canonical SMILES for 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine is Cc1ccc(-c2nnnn2-c2ccccn2)cc1.
What is the InChIKey of 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine?
The InChIKey is GLSSKCBDIAWLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5/c1-10-5-7-11(8-6-10)13-15-16-17-18(13)12-4-2-3-9-14-12/h2-9H,1H3.
What are the key properties of 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine?
2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine has a molecular weight of 237.27 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methylphenyl)tetrazol-1-yl]pyridine is sourced from PubChem (CID 152755489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).