9-(4-methyl-2,5-diphenylphenyl)carbazole

C31H23N — CID 167659525

IUPAC9-(4-methyl-2,5-diphenylphenyl)carbazole
SMILESCc1cc(-c2ccccc2)c(-n2c3ccccc3c3ccccc32)cc1-c1ccccc1
InChIInChI=1S/C31H23N/c1-22-20-28(24-14-6-3-7-15-24)31(21-27(22)23-12-4-2-5-13-23)32-29-18-10-8-16-25(29)26-17-9-11-19-30(26)32/h2-21H,1H3
InChIKeyRTFMBMXKLLAPJC-UHFFFAOYSA-N
MW409.53 g/mol
LogP8.43
Rot. Bonds3

About 9-(4-methyl-2,5-diphenylphenyl)carbazole

9-(4-methyl-2,5-diphenylphenyl)carbazole (PubChem CID 167659525) has the molecular formula C31H23N and a molecular weight of 409.53 g/mol. Its IUPAC name is 9-(4-methyl-2,5-diphenylphenyl)carbazole.

Molecular Properties

Compound Name9-(4-methyl-2,5-diphenylphenyl)carbazole
PubChem CID167659525
Molecular FormulaC31H23N
Molecular Weight409.53 g/mol
Exact Mass409.18
IUPAC Name9-(4-methyl-2,5-diphenylphenyl)carbazole
SMILESCc1cc(-c2ccccc2)c(-n2c3ccccc3c3ccccc32)cc1-c1ccccc1
InChIInChI=1S/C31H23N/c1-22-20-28(24-14-6-3-7-15-24)31(21-27(22)23-12-4-2-5-13-23)32-29-18-10-8-16-25(29)26-17-9-11-19-30(26)32/h2-21H,1H3
InChIKeyRTFMBMXKLLAPJC-UHFFFAOYSA-N
XLogP8.43
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.53
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-(4-methyl-2,5-diphenylphenyl)carbazole?
The IUPAC name of 9-(4-methyl-2,5-diphenylphenyl)carbazole (CID 167659525) is 9-(4-methyl-2,5-diphenylphenyl)carbazole.
What is the SMILES notation for 9-(4-methyl-2,5-diphenylphenyl)carbazole?
The canonical SMILES for 9-(4-methyl-2,5-diphenylphenyl)carbazole is Cc1cc(-c2ccccc2)c(-n2c3ccccc3c3ccccc32)cc1-c1ccccc1.
What is the InChIKey of 9-(4-methyl-2,5-diphenylphenyl)carbazole?
The InChIKey is RTFMBMXKLLAPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23N/c1-22-20-28(24-14-6-3-7-15-24)31(21-27(22)23-12-4-2-5-13-23)32-29-18-10-8-16-25(29)26-17-9-11-19-30(26)32/h2-21H,1H3.
What are the key properties of 9-(4-methyl-2,5-diphenylphenyl)carbazole?
9-(4-methyl-2,5-diphenylphenyl)carbazole has a molecular weight of 409.53 g/mol, XLogP of 8.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-methyl-2,5-diphenylphenyl)carbazole is sourced from PubChem (CID 167659525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).