2-tert-butyl-6-pyridin-2-ylpyridine

C14H16N2 — CID 15302114

IUPAC2-tert-butyl-6-pyridin-2-ylpyridine
SMILESCC(C)(C)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C14H16N2/c1-14(2,3)13-9-6-8-12(16-13)11-7-4-5-10-15-11/h4-10H,1-3H3
InChIKeyNZNVZDDBBNWKOQ-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.44
Rot. Bonds1

About 2-tert-butyl-6-pyridin-2-ylpyridine

2-tert-butyl-6-pyridin-2-ylpyridine (PubChem CID 15302114) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 2-tert-butyl-6-pyridin-2-ylpyridine.

Molecular Properties

Compound Name2-tert-butyl-6-pyridin-2-ylpyridine
PubChem CID15302114
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name2-tert-butyl-6-pyridin-2-ylpyridine
SMILESCC(C)(C)c1cccc(-c2ccccn2)n1
InChIInChI=1S/C14H16N2/c1-14(2,3)13-9-6-8-12(16-13)11-7-4-5-10-15-11/h4-10H,1-3H3
InChIKeyNZNVZDDBBNWKOQ-UHFFFAOYSA-N
XLogP3.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-pyridin-2-ylpyridine?
The IUPAC name of 2-tert-butyl-6-pyridin-2-ylpyridine (CID 15302114) is 2-tert-butyl-6-pyridin-2-ylpyridine.
What is the SMILES notation for 2-tert-butyl-6-pyridin-2-ylpyridine?
The canonical SMILES for 2-tert-butyl-6-pyridin-2-ylpyridine is CC(C)(C)c1cccc(-c2ccccn2)n1.
What is the InChIKey of 2-tert-butyl-6-pyridin-2-ylpyridine?
The InChIKey is NZNVZDDBBNWKOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-14(2,3)13-9-6-8-12(16-13)11-7-4-5-10-15-11/h4-10H,1-3H3.
What are the key properties of 2-tert-butyl-6-pyridin-2-ylpyridine?
2-tert-butyl-6-pyridin-2-ylpyridine has a molecular weight of 212.30 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-pyridin-2-ylpyridine is sourced from PubChem (CID 15302114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).