9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole

C36H26N2 — CID 145333962

IUPAC9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole
SMILESCc1cccc(-c2ccc3c4ccccc4n(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)c3c2)c1
InChIInChI=1S/C36H26N2/c1-25-11-10-16-28(21-25)29-19-20-32-31-17-8-9-18-35(31)38(36(32)22-29)30-23-33(26-12-4-2-5-13-26)37-34(24-30)27-14-6-3-7-15-27/h2-24H,1H3
InChIKeyHCZFPTFSXSDWFZ-UHFFFAOYSA-N
MW486.62 g/mol
LogP9.49
Rot. Bonds4

About 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole

9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole (PubChem CID 145333962) has the molecular formula C36H26N2 and a molecular weight of 486.62 g/mol. Its IUPAC name is 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole.

Molecular Properties

Compound Name9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole
PubChem CID145333962
Molecular FormulaC36H26N2
Molecular Weight486.62 g/mol
Exact Mass486.21
IUPAC Name9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole
SMILESCc1cccc(-c2ccc3c4ccccc4n(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)c3c2)c1
InChIInChI=1S/C36H26N2/c1-25-11-10-16-28(21-25)29-19-20-32-31-17-8-9-18-35(31)38(36(32)22-29)30-23-33(26-12-4-2-5-13-26)37-34(24-30)27-14-6-3-7-15-27/h2-24H,1H3
InChIKeyHCZFPTFSXSDWFZ-UHFFFAOYSA-N
XLogP9.49
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms38
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.62
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole?
The IUPAC name of 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole (CID 145333962) is 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole.
What is the SMILES notation for 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole?
The canonical SMILES for 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole is Cc1cccc(-c2ccc3c4ccccc4n(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)c3c2)c1.
What is the InChIKey of 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole?
The InChIKey is HCZFPTFSXSDWFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2/c1-25-11-10-16-28(21-25)29-19-20-32-31-17-8-9-18-35(31)38(36(32)22-29)30-23-33(26-12-4-2-5-13-26)37-34(24-30)27-14-6-3-7-15-27/h2-24H,1H3.
What are the key properties of 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole?
9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole has a molecular weight of 486.62 g/mol, XLogP of 9.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole is sourced from PubChem (CID 145333962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).