2-(2,5-diphenylphenyl)-9H-carbazole

C30H21N — CID 177269985

IUPAC2-(2,5-diphenylphenyl)-9H-carbazole
SMILESc1ccc(-c2ccc(-c3ccccc3)c(-c3ccc4c(c3)[nH]c3ccccc34)c2)cc1
InChIInChI=1S/C30H21N/c1-3-9-21(10-4-1)23-15-17-25(22-11-5-2-6-12-22)28(19-23)24-16-18-27-26-13-7-8-14-29(26)31-30(27)20-24/h1-20,31H
InChIKeyKKWKCPJNYPXXTP-UHFFFAOYSA-N
MW395.51 g/mol
LogP8.32
Rot. Bonds3

About 2-(2,5-diphenylphenyl)-9H-carbazole

2-(2,5-diphenylphenyl)-9H-carbazole (PubChem CID 177269985) has the molecular formula C30H21N and a molecular weight of 395.51 g/mol. Its IUPAC name is 2-(2,5-diphenylphenyl)-9H-carbazole.

Molecular Properties

Compound Name2-(2,5-diphenylphenyl)-9H-carbazole
PubChem CID177269985
Molecular FormulaC30H21N
Molecular Weight395.51 g/mol
Exact Mass395.17
IUPAC Name2-(2,5-diphenylphenyl)-9H-carbazole
SMILESc1ccc(-c2ccc(-c3ccccc3)c(-c3ccc4c(c3)[nH]c3ccccc34)c2)cc1
InChIInChI=1S/C30H21N/c1-3-9-21(10-4-1)23-15-17-25(22-11-5-2-6-12-22)28(19-23)24-16-18-27-26-13-7-8-14-29(26)31-30(27)20-24/h1-20,31H
InChIKeyKKWKCPJNYPXXTP-UHFFFAOYSA-N
XLogP8.32
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.51
LogP ≤ 58.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diphenylphenyl)-9H-carbazole?
The IUPAC name of 2-(2,5-diphenylphenyl)-9H-carbazole (CID 177269985) is 2-(2,5-diphenylphenyl)-9H-carbazole.
What is the SMILES notation for 2-(2,5-diphenylphenyl)-9H-carbazole?
The canonical SMILES for 2-(2,5-diphenylphenyl)-9H-carbazole is c1ccc(-c2ccc(-c3ccccc3)c(-c3ccc4c(c3)[nH]c3ccccc34)c2)cc1.
What is the InChIKey of 2-(2,5-diphenylphenyl)-9H-carbazole?
The InChIKey is KKWKCPJNYPXXTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H21N/c1-3-9-21(10-4-1)23-15-17-25(22-11-5-2-6-12-22)28(19-23)24-16-18-27-26-13-7-8-14-29(26)31-30(27)20-24/h1-20,31H.
What are the key properties of 2-(2,5-diphenylphenyl)-9H-carbazole?
2-(2,5-diphenylphenyl)-9H-carbazole has a molecular weight of 395.51 g/mol, XLogP of 8.32, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diphenylphenyl)-9H-carbazole is sourced from PubChem (CID 177269985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).