2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine

C19H26N2 — CID 139501596

IUPAC2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine
SMILESCc1cccc(C(C)(C)Cc2ccc(C(C)(C)C)nc2)n1
InChIInChI=1S/C19H26N2/c1-14-8-7-9-17(21-14)19(5,6)12-15-10-11-16(20-13-15)18(2,3)4/h7-11,13H,12H2,1-6H3
InChIKeyRPCHINMNHDXRRU-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.60
Rot. Bonds3

About 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine

2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine (PubChem CID 139501596) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine.

Molecular Properties

Compound Name2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine
PubChem CID139501596
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine
SMILESCc1cccc(C(C)(C)Cc2ccc(C(C)(C)C)nc2)n1
InChIInChI=1S/C19H26N2/c1-14-8-7-9-17(21-14)19(5,6)12-15-10-11-16(20-13-15)18(2,3)4/h7-11,13H,12H2,1-6H3
InChIKeyRPCHINMNHDXRRU-UHFFFAOYSA-N
XLogP4.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine?
The IUPAC name of 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine (CID 139501596) is 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine.
What is the SMILES notation for 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine?
The canonical SMILES for 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine is Cc1cccc(C(C)(C)Cc2ccc(C(C)(C)C)nc2)n1.
What is the InChIKey of 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine?
The InChIKey is RPCHINMNHDXRRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-14-8-7-9-17(21-14)19(5,6)12-15-10-11-16(20-13-15)18(2,3)4/h7-11,13H,12H2,1-6H3.
What are the key properties of 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine?
2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine has a molecular weight of 282.43 g/mol, XLogP of 4.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-[2-methyl-2-(6-methyl-2-pyridinyl)propyl]pyridine is sourced from PubChem (CID 139501596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).