2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine

C24H22N4 — CID 101128259

IUPAC2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine
SMILESCc1cccc(-c2ccc(CCc3ccc(-c4cccc(C)n4)nc3)cn2)n1
InChIInChI=1S/C24H22N4/c1-17-5-3-7-23(27-17)21-13-11-19(15-25-21)9-10-20-12-14-22(26-16-20)24-8-4-6-18(2)28-24/h3-8,11-16H,9-10H2,1-2H3
InChIKeyHLQOXUZVYWGYAT-UHFFFAOYSA-N
MW366.47 g/mol
LogP5.00
Rot. Bonds5

About 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine

2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine (PubChem CID 101128259) has the molecular formula C24H22N4 and a molecular weight of 366.47 g/mol. Its IUPAC name is 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine
PubChem CID101128259
Molecular FormulaC24H22N4
Molecular Weight366.47 g/mol
Exact Mass366.18
IUPAC Name2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine
SMILESCc1cccc(-c2ccc(CCc3ccc(-c4cccc(C)n4)nc3)cn2)n1
InChIInChI=1S/C24H22N4/c1-17-5-3-7-23(27-17)21-13-11-19(15-25-21)9-10-20-12-14-22(26-16-20)24-8-4-6-18(2)28-24/h3-8,11-16H,9-10H2,1-2H3
InChIKeyHLQOXUZVYWGYAT-UHFFFAOYSA-N
XLogP5.00
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.47
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine?
The IUPAC name of 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine (CID 101128259) is 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine.
What is the SMILES notation for 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine?
The canonical SMILES for 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine is Cc1cccc(-c2ccc(CCc3ccc(-c4cccc(C)n4)nc3)cn2)n1.
What is the InChIKey of 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine?
The InChIKey is HLQOXUZVYWGYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4/c1-17-5-3-7-23(27-17)21-13-11-19(15-25-21)9-10-20-12-14-22(26-16-20)24-8-4-6-18(2)28-24/h3-8,11-16H,9-10H2,1-2H3.
What are the key properties of 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine?
2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine has a molecular weight of 366.47 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[5-[2-[6-(6-methyl-2-pyridinyl)-3-pyridinyl]ethyl]-2-pyridinyl]pyridine is sourced from PubChem (CID 101128259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).