4-cyclohexyl-2,6-diphenylpyridine

C23H23N — CID 13415243

IUPAC4-cyclohexyl-2,6-diphenylpyridine
SMILESc1ccc(-c2cc(C3CCCCC3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H23N/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h2-3,6-9,12-18H,1,4-5,10-11H2
InChIKeyKHUIPMKUYBEEKW-UHFFFAOYSA-N
MW313.44 g/mol
LogP6.46
Rot. Bonds3

About 4-cyclohexyl-2,6-diphenylpyridine

4-cyclohexyl-2,6-diphenylpyridine (PubChem CID 13415243) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is 4-cyclohexyl-2,6-diphenylpyridine.

Molecular Properties

Compound Name4-cyclohexyl-2,6-diphenylpyridine
PubChem CID13415243
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC Name4-cyclohexyl-2,6-diphenylpyridine
SMILESc1ccc(-c2cc(C3CCCCC3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H23N/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h2-3,6-9,12-18H,1,4-5,10-11H2
InChIKeyKHUIPMKUYBEEKW-UHFFFAOYSA-N
XLogP6.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.44
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-2,6-diphenylpyridine?
The IUPAC name of 4-cyclohexyl-2,6-diphenylpyridine (CID 13415243) is 4-cyclohexyl-2,6-diphenylpyridine.
What is the SMILES notation for 4-cyclohexyl-2,6-diphenylpyridine?
The canonical SMILES for 4-cyclohexyl-2,6-diphenylpyridine is c1ccc(-c2cc(C3CCCCC3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 4-cyclohexyl-2,6-diphenylpyridine?
The InChIKey is KHUIPMKUYBEEKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N/c1-4-10-18(11-5-1)21-16-22(19-12-6-2-7-13-19)24-23(17-21)20-14-8-3-9-15-20/h2-3,6-9,12-18H,1,4-5,10-11H2.
What are the key properties of 4-cyclohexyl-2,6-diphenylpyridine?
4-cyclohexyl-2,6-diphenylpyridine has a molecular weight of 313.44 g/mol, XLogP of 6.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-2,6-diphenylpyridine is sourced from PubChem (CID 13415243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).