2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine

C42H33N — CID 121315369

IUPAC2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine
SMILESCC(C)(c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1)c1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C42H33N/c1-42(2,36-24-20-32(21-25-36)39-19-11-17-31-14-9-10-18-38(31)39)37-26-22-34(23-27-37)41-29-35(30-12-5-3-6-13-30)28-40(43-41)33-15-7-4-8-16-33/h3-29H,1-2H3
InChIKeyKLDFXAOWLHMEHD-UHFFFAOYSA-N
MW551.73 g/mol
LogP11.23
Rot. Bonds6

About 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine

2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine (PubChem CID 121315369) has the molecular formula C42H33N and a molecular weight of 551.73 g/mol. Its IUPAC name is 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine.

Molecular Properties

Compound Name2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine
PubChem CID121315369
Molecular FormulaC42H33N
Molecular Weight551.73 g/mol
Exact Mass551.26
IUPAC Name2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine
SMILESCC(C)(c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1)c1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C42H33N/c1-42(2,36-24-20-32(21-25-36)39-19-11-17-31-14-9-10-18-38(31)39)37-26-22-34(23-27-37)41-29-35(30-12-5-3-6-13-30)28-40(43-41)33-15-7-4-8-16-33/h3-29H,1-2H3
InChIKeyKLDFXAOWLHMEHD-UHFFFAOYSA-N
XLogP11.23
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500551.73
LogP ≤ 511.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-naphthalen-1-yl-6-[4-[2-[4-(6-naphthalen-1-yl-2-phenylpyrimidin-4-yl)phenyl]propan-2-yl]phenyl]-2-phenylpyrimidine
CID 130392242
2-[4-[2-[4-(3-naphthalen-1-ylphenyl)phenyl]propan-2-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-[4-[2-(4-naphthalen-2-ylphenyl)propan-2-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[2-[4-(3-phenylphenyl)phenyl]propan-2-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[2-[4-(4-phenylphenyl)phenyl]propan-2-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[2-(4-phenylphenyl)propan-2-yl]phenyl]-1,3,5-triazine
CID 158095916
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130260993
2-[4-[5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine
CID 118075155
2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine
CID 118901430
2-[4-[5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]naphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121402218
4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 161366762
4-naphthalen-1-yl-6-(4-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)pyrimidine
CID 159653771
2-[5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine;2-[5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine
CID 159163792
4-(4-naphthalen-1-ylphenyl)-6-(7-phenylphenanthren-2-yl)-2-(4-phenylphenyl)pyrimidine
CID 168844850
4-naphthalen-1-yl-2-[4-[3-[4-(4-naphthalen-1-yl-6-phenylpyrimidin-2-yl)phenyl]pentan-3-yl]phenyl]-6-phenylpyrimidine;4-phenyl-6-(4-phenylphenyl)-2-[4-[3-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]pentan-3-yl]phenyl]pyrimidine
CID 159364368
2-[4-[2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]propan-2-yl]phenyl]-4,6-diphenylpyrimidine
CID 121315643

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine?
The IUPAC name of 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine (CID 121315369) is 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine.
What is the SMILES notation for 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine?
The canonical SMILES for 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine is CC(C)(c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)n2)cc1)c1ccc(-c2cccc3ccccc23)cc1.
What is the InChIKey of 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine?
The InChIKey is KLDFXAOWLHMEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H33N/c1-42(2,36-24-20-32(21-25-36)39-19-11-17-31-14-9-10-18-38(31)39)37-26-22-34(23-27-37)41-29-35(30-12-5-3-6-13-30)28-40(43-41)33-15-7-4-8-16-33/h3-29H,1-2H3.
What are the key properties of 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine?
2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine has a molecular weight of 551.73 g/mol, XLogP of 11.23, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine is sourced from PubChem (CID 121315369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).