2,5-bis(4-ethylphenyl)pyridine

C21H21N — CID 101383412

IUPAC2,5-bis(4-ethylphenyl)pyridine
SMILESCCc1ccc(-c2ccc(-c3ccc(CC)cc3)nc2)cc1
InChIInChI=1S/C21H21N/c1-3-16-5-9-18(10-6-16)20-13-14-21(22-15-20)19-11-7-17(4-2)8-12-19/h5-15H,3-4H2,1-2H3
InChIKeyUYDVWTLRRYGSOA-UHFFFAOYSA-N
MW287.41 g/mol
LogP5.54
Rot. Bonds4

About 2,5-bis(4-ethylphenyl)pyridine

2,5-bis(4-ethylphenyl)pyridine (PubChem CID 101383412) has the molecular formula C21H21N and a molecular weight of 287.41 g/mol. Its IUPAC name is 2,5-bis(4-ethylphenyl)pyridine.

Molecular Properties

Compound Name2,5-bis(4-ethylphenyl)pyridine
PubChem CID101383412
Molecular FormulaC21H21N
Molecular Weight287.41 g/mol
Exact Mass287.17
IUPAC Name2,5-bis(4-ethylphenyl)pyridine
SMILESCCc1ccc(-c2ccc(-c3ccc(CC)cc3)nc2)cc1
InChIInChI=1S/C21H21N/c1-3-16-5-9-18(10-6-16)20-13-14-21(22-15-20)19-11-7-17(4-2)8-12-19/h5-15H,3-4H2,1-2H3
InChIKeyUYDVWTLRRYGSOA-UHFFFAOYSA-N
XLogP5.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.41
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-ethylphenyl)pyridine?
The IUPAC name of 2,5-bis(4-ethylphenyl)pyridine (CID 101383412) is 2,5-bis(4-ethylphenyl)pyridine.
What is the SMILES notation for 2,5-bis(4-ethylphenyl)pyridine?
The canonical SMILES for 2,5-bis(4-ethylphenyl)pyridine is CCc1ccc(-c2ccc(-c3ccc(CC)cc3)nc2)cc1.
What is the InChIKey of 2,5-bis(4-ethylphenyl)pyridine?
The InChIKey is UYDVWTLRRYGSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N/c1-3-16-5-9-18(10-6-16)20-13-14-21(22-15-20)19-11-7-17(4-2)8-12-19/h5-15H,3-4H2,1-2H3.
What are the key properties of 2,5-bis(4-ethylphenyl)pyridine?
2,5-bis(4-ethylphenyl)pyridine has a molecular weight of 287.41 g/mol, XLogP of 5.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-ethylphenyl)pyridine is sourced from PubChem (CID 101383412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).