3,5-bis(triazol-1-yl)pyridine

C9H7N7 — CID 164853015

IUPAC3,5-bis(triazol-1-yl)pyridine
SMILESc1cn(-c2cncc(-n3ccnn3)c2)nn1
InChIInChI=1S/C9H7N7/c1-3-15(13-11-1)8-5-9(7-10-6-8)16-4-2-12-14-16/h1-7H
InChIKeyFBZJHKIVGBZUJB-UHFFFAOYSA-N
MW213.20 g/mol
LogP0.24
Rot. Bonds2

About 3,5-bis(triazol-1-yl)pyridine

3,5-bis(triazol-1-yl)pyridine (PubChem CID 164853015) has the molecular formula C9H7N7 and a molecular weight of 213.20 g/mol. Its IUPAC name is 3,5-bis(triazol-1-yl)pyridine.

Molecular Properties

Compound Name3,5-bis(triazol-1-yl)pyridine
PubChem CID164853015
Molecular FormulaC9H7N7
Molecular Weight213.20 g/mol
Exact Mass213.08
IUPAC Name3,5-bis(triazol-1-yl)pyridine
SMILESc1cn(-c2cncc(-n3ccnn3)c2)nn1
InChIInChI=1S/C9H7N7/c1-3-15(13-11-1)8-5-9(7-10-6-8)16-4-2-12-14-16/h1-7H
InChIKeyFBZJHKIVGBZUJB-UHFFFAOYSA-N
XLogP0.24
TPSA74.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3,5-bis(triazol-1-yl)pyridine?
The IUPAC name of 3,5-bis(triazol-1-yl)pyridine (CID 164853015) is 3,5-bis(triazol-1-yl)pyridine.
What is the SMILES notation for 3,5-bis(triazol-1-yl)pyridine?
The canonical SMILES for 3,5-bis(triazol-1-yl)pyridine is c1cn(-c2cncc(-n3ccnn3)c2)nn1.
What is the InChIKey of 3,5-bis(triazol-1-yl)pyridine?
The InChIKey is FBZJHKIVGBZUJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N7/c1-3-15(13-11-1)8-5-9(7-10-6-8)16-4-2-12-14-16/h1-7H.
What are the key properties of 3,5-bis(triazol-1-yl)pyridine?
3,5-bis(triazol-1-yl)pyridine has a molecular weight of 213.20 g/mol, XLogP of 0.24, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(triazol-1-yl)pyridine is sourced from PubChem (CID 164853015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).