2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine

C16H11N7 — CID 10149553

IUPAC2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine
SMILESc1ccc(-c2nnn(-c3ccc(-c4cccnc4)nc3)n2)nc1
InChIInChI=1S/C16H11N7/c1-2-9-18-15(5-1)16-20-22-23(21-16)13-6-7-14(19-11-13)12-4-3-8-17-10-12/h1-11H
InChIKeyLBXCFLHJKBHIBC-UHFFFAOYSA-N
MW301.31 g/mol
LogP2.18
Rot. Bonds3

About 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine

2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine (PubChem CID 10149553) has the molecular formula C16H11N7 and a molecular weight of 301.31 g/mol. Its IUPAC name is 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine.

Molecular Properties

Compound Name2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine
PubChem CID10149553
Molecular FormulaC16H11N7
Molecular Weight301.31 g/mol
Exact Mass301.11
IUPAC Name2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine
SMILESc1ccc(-c2nnn(-c3ccc(-c4cccnc4)nc3)n2)nc1
InChIInChI=1S/C16H11N7/c1-2-9-18-15(5-1)16-20-22-23(21-16)13-6-7-14(19-11-13)12-4-3-8-17-10-12/h1-11H
InChIKeyLBXCFLHJKBHIBC-UHFFFAOYSA-N
XLogP2.18
TPSA82.27 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.31
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine?
The IUPAC name of 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine (CID 10149553) is 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine.
What is the SMILES notation for 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine?
The canonical SMILES for 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine is c1ccc(-c2nnn(-c3ccc(-c4cccnc4)nc3)n2)nc1.
What is the InChIKey of 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine?
The InChIKey is LBXCFLHJKBHIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N7/c1-2-9-18-15(5-1)16-20-22-23(21-16)13-6-7-14(19-11-13)12-4-3-8-17-10-12/h1-11H.
What are the key properties of 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine?
2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine has a molecular weight of 301.31 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-5-(5-pyridin-2-yltetrazol-2-yl)pyridine is sourced from PubChem (CID 10149553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).