2-ethyl-6-methyl-3,4,5-triphenylpyridine

C26H23N — CID 67766803

IUPAC2-ethyl-6-methyl-3,4,5-triphenylpyridine
SMILESCCc1nc(C)c(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C26H23N/c1-3-23-25(21-15-9-5-10-16-21)26(22-17-11-6-12-18-22)24(19(2)27-23)20-13-7-4-8-14-20/h4-18H,3H2,1-2H3
InChIKeyQCSSDJZRHCEACO-UHFFFAOYSA-N
MW349.48 g/mol
LogP6.95
Rot. Bonds4

About 2-ethyl-6-methyl-3,4,5-triphenylpyridine

2-ethyl-6-methyl-3,4,5-triphenylpyridine (PubChem CID 67766803) has the molecular formula C26H23N and a molecular weight of 349.48 g/mol. Its IUPAC name is 2-ethyl-6-methyl-3,4,5-triphenylpyridine.

Molecular Properties

Compound Name2-ethyl-6-methyl-3,4,5-triphenylpyridine
PubChem CID67766803
Molecular FormulaC26H23N
Molecular Weight349.48 g/mol
Exact Mass349.18
IUPAC Name2-ethyl-6-methyl-3,4,5-triphenylpyridine
SMILESCCc1nc(C)c(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C26H23N/c1-3-23-25(21-15-9-5-10-16-21)26(22-17-11-6-12-18-22)24(19(2)27-23)20-13-7-4-8-14-20/h4-18H,3H2,1-2H3
InChIKeyQCSSDJZRHCEACO-UHFFFAOYSA-N
XLogP6.95
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.48
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methyl-3,4,5-triphenylpyridine?
The IUPAC name of 2-ethyl-6-methyl-3,4,5-triphenylpyridine (CID 67766803) is 2-ethyl-6-methyl-3,4,5-triphenylpyridine.
What is the SMILES notation for 2-ethyl-6-methyl-3,4,5-triphenylpyridine?
The canonical SMILES for 2-ethyl-6-methyl-3,4,5-triphenylpyridine is CCc1nc(C)c(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-ethyl-6-methyl-3,4,5-triphenylpyridine?
The InChIKey is QCSSDJZRHCEACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N/c1-3-23-25(21-15-9-5-10-16-21)26(22-17-11-6-12-18-22)24(19(2)27-23)20-13-7-4-8-14-20/h4-18H,3H2,1-2H3.
What are the key properties of 2-ethyl-6-methyl-3,4,5-triphenylpyridine?
2-ethyl-6-methyl-3,4,5-triphenylpyridine has a molecular weight of 349.48 g/mol, XLogP of 6.95, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-3,4,5-triphenylpyridine is sourced from PubChem (CID 67766803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).