2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine

C34H32N2 — CID 23528053

IUPAC2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
SMILESCc1cc(C)c(-c2ccc(-c3cc(-c4c(C)cc(C)cc4C)cc(-c4ccccc4)n3)nc2)c(C)c1
InChIInChI=1S/C34H32N2/c1-21-14-23(3)33(24(4)15-21)28-12-13-30(35-20-28)32-19-29(34-25(5)16-22(2)17-26(34)6)18-31(36-32)27-10-8-7-9-11-27/h7-20H,1-6H3
InChIKeyMNIOVTOWTFKSTE-UHFFFAOYSA-N
MW468.64 g/mol
LogP9.00
Rot. Bonds4

About 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine

2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine (PubChem CID 23528053) has the molecular formula C34H32N2 and a molecular weight of 468.64 g/mol. Its IUPAC name is 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
PubChem CID23528053
Molecular FormulaC34H32N2
Molecular Weight468.64 g/mol
Exact Mass468.26
IUPAC Name2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine
SMILESCc1cc(C)c(-c2ccc(-c3cc(-c4c(C)cc(C)cc4C)cc(-c4ccccc4)n3)nc2)c(C)c1
InChIInChI=1S/C34H32N2/c1-21-14-23(3)33(24(4)15-21)28-12-13-30(35-20-28)32-19-29(34-25(5)16-22(2)17-26(34)6)18-31(36-32)27-10-8-7-9-11-27/h7-20H,1-6H3
InChIKeyMNIOVTOWTFKSTE-UHFFFAOYSA-N
XLogP9.00
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.64
LogP ≤ 59.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The IUPAC name of 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine (CID 23528053) is 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine.
What is the SMILES notation for 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The canonical SMILES for 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine is Cc1cc(C)c(-c2ccc(-c3cc(-c4c(C)cc(C)cc4C)cc(-c4ccccc4)n3)nc2)c(C)c1.
What is the InChIKey of 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
The InChIKey is MNIOVTOWTFKSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32N2/c1-21-14-23(3)33(24(4)15-21)28-12-13-30(35-20-28)32-19-29(34-25(5)16-22(2)17-26(34)6)18-31(36-32)27-10-8-7-9-11-27/h7-20H,1-6H3.
What are the key properties of 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine?
2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine has a molecular weight of 468.64 g/mol, XLogP of 9.00, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(2,4,6-trimethylphenyl)-6-[5-(2,4,6-trimethylphenyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 23528053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).