4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine

C30H23N — CID 159742768

IUPAC4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine
SMILES[2H]C([2H])([2H])c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)ccn3)c2)cc1
InChIInChI=1S/C30H23N/c1-22-10-12-25(13-11-22)27-8-5-9-29(20-27)30-21-28(18-19-31-30)26-16-14-24(15-17-26)23-6-3-2-4-7-23/h2-21H,1H3/i1D3
InChIKeyIYMJNMPSDMCEIL-FIBGUPNXSA-N
MW400.54 g/mol
LogP8.06
Rot. Bonds5

About 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine

4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine (PubChem CID 159742768) has the molecular formula C30H23N and a molecular weight of 400.54 g/mol. Its IUPAC name is 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine.

Molecular Properties

Compound Name4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine
PubChem CID159742768
Molecular FormulaC30H23N
Molecular Weight400.54 g/mol
Exact Mass400.20
IUPAC Name4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine
SMILES[2H]C([2H])([2H])c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)ccn3)c2)cc1
InChIInChI=1S/C30H23N/c1-22-10-12-25(13-11-22)27-8-5-9-29(20-27)30-21-28(18-19-31-30)26-16-14-24(15-17-26)23-6-3-2-4-7-23/h2-21H,1H3/i1D3
InChIKeyIYMJNMPSDMCEIL-FIBGUPNXSA-N
XLogP8.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.54
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-phenyl-2-(3-phenylphenyl)pyridine
CID 58028222
2-[4-[2-[3-[2-[4-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-5-[2-[4-[4-(trideuteriomethyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(trideuteriomethyl)pyridine
CID 153457967
4-(3-phenylphenyl)-2-[4-[2-[3-[2-[4-[4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 153434672
4-(3-methylphenyl)-2-(4-methylphenyl)pyridine
CID 118345294
2-(5-methyl-2-pyridinyl)-5-[3-[3-[2-[2-[3-[2-[3-[3-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-4-pyridinyl]phenyl]phenyl]phenyl]-4-(trideuteriomethyl)pyridine
CID 159274930
osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
CID 159449942
5-(2-phenyl-4-pyridinyl)-2-(trideuteriomethyl)pyrimidine
CID 154623465
2-[3-[3-(4-methyl-2-pyridinyl)phenyl]phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 146586988
2-[3-(1-deuterio-1-phenylethyl)phenyl]-4-phenylpyridine
CID 162710584
2-[3-[4-[4-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 171461302
4-[4-(2-deuteriopropan-2-yl)phenyl]-2-phenylpyridine
CID 140831627
dimethyl-phenyl-[2-(3-phenylphenyl)-4-pyridinyl]germane
CID 140726269

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine?
The IUPAC name of 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine (CID 159742768) is 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine.
What is the SMILES notation for 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine?
The canonical SMILES for 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine is [2H]C([2H])([2H])c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)ccn3)c2)cc1.
What is the InChIKey of 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine?
The InChIKey is IYMJNMPSDMCEIL-FIBGUPNXSA-N. The full InChI is InChI=1S/C30H23N/c1-22-10-12-25(13-11-22)27-8-5-9-29(20-27)30-21-28(18-19-31-30)26-16-14-24(15-17-26)23-6-3-2-4-7-23/h2-21H,1H3/i1D3.
What are the key properties of 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine?
4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine has a molecular weight of 400.54 g/mol, XLogP of 8.06, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenylphenyl)-2-[3-[4-(trideuteriomethyl)phenyl]phenyl]pyridine is sourced from PubChem (CID 159742768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).