2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine

C39H35N3 — CID 162495630

IUPAC2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine
SMILESCC(Cc1ccccc1)(c1cccc(-c2cccc(C(C)(Cc3ccccc3)c3ccccn3)n2)c1)c1ccccn1
InChIInChI=1S/C39H35N3/c1-38(35-22-9-11-25-40-35,28-30-15-5-3-6-16-30)33-20-13-19-32(27-33)34-21-14-24-37(42-34)39(2,36-23-10-12-26-41-36)29-31-17-7-4-8-18-31/h3-27H,28-29H2,1-2H3
InChIKeyNHBQCVDSPBATEC-UHFFFAOYSA-N
MW545.73 g/mol
LogP8.64
Rot. Bonds9

About 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine

2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine (PubChem CID 162495630) has the molecular formula C39H35N3 and a molecular weight of 545.73 g/mol. Its IUPAC name is 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine.

Molecular Properties

Compound Name2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine
PubChem CID162495630
Molecular FormulaC39H35N3
Molecular Weight545.73 g/mol
Exact Mass545.28
IUPAC Name2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine
SMILESCC(Cc1ccccc1)(c1cccc(-c2cccc(C(C)(Cc3ccccc3)c3ccccn3)n2)c1)c1ccccn1
InChIInChI=1S/C39H35N3/c1-38(35-22-9-11-25-40-35,28-30-15-5-3-6-16-30)33-20-13-19-32(27-33)34-21-14-24-37(42-34)39(2,36-23-10-12-26-41-36)29-31-17-7-4-8-18-31/h3-27H,28-29H2,1-2H3
InChIKeyNHBQCVDSPBATEC-UHFFFAOYSA-N
XLogP8.64
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500545.73
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-phenyl-3-pyridin-2-ylbutyl)-6-[3-(3-phenyl-3-pyridin-2-ylbutyl)phenyl]pyridine
CID 162495590
2-phenyl-6-(2-pyridin-2-ylpropan-2-yl)pyridine
CID 58752837
2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol
CID 140805992
2-[2-(3-phenylphenyl)propan-2-yl]-6-(5-pyridin-2-yl-3-pyridinyl)pyridine
CID 58004258
2-[1,1-bis(methylsulfanyl)-2-phenylethyl]pyridine
CID 23584919
1-(4-phenylphenyl)-2-[4-[6-(2-phenyl-2-pyridin-2-ylpropyl)-2-pyridinyl]dibenzofuran-2-yl]-1-pyridin-2-ylethanol
CID 171052701
5-bromo-2-(2-phenyl-2-pyridin-2-ylpropyl)benzaldehyde
CID 132539690
2-[3,5-bis[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenyl]-6-(3-pyridin-2-ylphenyl)pyridine
CID 102128660
7-(2,2-dimethylpropyl)-3-[(1R)-1-phenyl-1-pyridin-2-ylethyl]-1-[3-(1-phenyl-1-pyridin-2-ylethyl)phenyl]-[1]benzothiolo[2,3-c]pyridine
CID 154622364
(3,5-ditert-butylphenyl)-(6-phenyl-2-pyridinyl)-(3-pyridin-2-ylphenyl)borane
CID 140800998
2-methyl-2-[6-[6-[3-(trifluoromethyl)phenyl]-2-pyridinyl]-2-pyridinyl]propanoic acid
CID 58004358
2-(3-phenyl-3-pyridin-2-ylbutyl)-6-[8-(3-phenyl-3-pyridin-2-ylbutyl)naphtho[1,2-b][1]benzofuran-10-yl]pyridine
CID 162495577

Frequently Asked Questions

What is the IUPAC name of 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine?
The IUPAC name of 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine (CID 162495630) is 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine.
What is the SMILES notation for 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine?
The canonical SMILES for 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine is CC(Cc1ccccc1)(c1cccc(-c2cccc(C(C)(Cc3ccccc3)c3ccccn3)n2)c1)c1ccccn1.
What is the InChIKey of 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine?
The InChIKey is NHBQCVDSPBATEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H35N3/c1-38(35-22-9-11-25-40-35,28-30-15-5-3-6-16-30)33-20-13-19-32(27-33)34-21-14-24-37(42-34)39(2,36-23-10-12-26-41-36)29-31-17-7-4-8-18-31/h3-27H,28-29H2,1-2H3.
What are the key properties of 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine?
2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine has a molecular weight of 545.73 g/mol, XLogP of 8.64, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenyl-2-pyridin-2-ylpropan-2-yl)-6-[3-(1-phenyl-2-pyridin-2-ylpropan-2-yl)phenyl]pyridine is sourced from PubChem (CID 162495630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).