4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine

C18H24N2 — CID 4249187

IUPAC4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1
InChIInChI=1S/C18H24N2/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6/h7-12H,1-6H3
InChIKeyTXNLQUKVUJITMX-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.74
Rot. Bonds1

About 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine

4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine (PubChem CID 4249187) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine
PubChem CID4249187
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1
InChIInChI=1S/C18H24N2/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6/h7-12H,1-6H3
InChIKeyTXNLQUKVUJITMX-UHFFFAOYSA-N
XLogP4.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-tert-butyl-2-(4-tert-butyl-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 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine?
The IUPAC name of 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine (CID 4249187) is 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine.
What is the SMILES notation for 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine?
The canonical SMILES for 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine is CC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.
What is the InChIKey of 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine?
The InChIKey is TXNLQUKVUJITMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6/h7-12H,1-6H3.
What are the key properties of 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine?
4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine has a molecular weight of 268.40 g/mol, XLogP of 4.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine is sourced from PubChem (CID 4249187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).