2-carbazol-9-yl-9-phenylcarbazole

C30H20N2 — CID 118335086

IUPAC2-carbazol-9-yl-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1
InChIInChI=1S/C30H20N2/c1-2-10-21(11-3-1)31-27-15-7-6-14-25(27)26-19-18-22(20-30(26)31)32-28-16-8-4-12-23(28)24-13-5-9-17-29(24)32/h1-20H
InChIKeyQFKKZGVXLMDEHM-UHFFFAOYSA-N
MW408.50 g/mol
LogP7.88
Rot. Bonds2

About 2-carbazol-9-yl-9-phenylcarbazole

2-carbazol-9-yl-9-phenylcarbazole (PubChem CID 118335086) has the molecular formula C30H20N2 and a molecular weight of 408.50 g/mol. Its IUPAC name is 2-carbazol-9-yl-9-phenylcarbazole.

Molecular Properties

Compound Name2-carbazol-9-yl-9-phenylcarbazole
PubChem CID118335086
Molecular FormulaC30H20N2
Molecular Weight408.50 g/mol
Exact Mass408.16
IUPAC Name2-carbazol-9-yl-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1
InChIInChI=1S/C30H20N2/c1-2-10-21(11-3-1)31-27-15-7-6-14-25(27)26-19-18-22(20-30(26)31)32-28-16-8-4-12-23(28)24-13-5-9-17-29(24)32/h1-20H
InChIKeyQFKKZGVXLMDEHM-UHFFFAOYSA-N
XLogP7.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.50
LogP ≤ 57.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-9-phenylcarbazole?
The IUPAC name of 2-carbazol-9-yl-9-phenylcarbazole (CID 118335086) is 2-carbazol-9-yl-9-phenylcarbazole.
What is the SMILES notation for 2-carbazol-9-yl-9-phenylcarbazole?
The canonical SMILES for 2-carbazol-9-yl-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccccc54)cc32)cc1.
What is the InChIKey of 2-carbazol-9-yl-9-phenylcarbazole?
The InChIKey is QFKKZGVXLMDEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N2/c1-2-10-21(11-3-1)31-27-15-7-6-14-25(27)26-19-18-22(20-30(26)31)32-28-16-8-4-12-23(28)24-13-5-9-17-29(24)32/h1-20H.
What are the key properties of 2-carbazol-9-yl-9-phenylcarbazole?
2-carbazol-9-yl-9-phenylcarbazole has a molecular weight of 408.50 g/mol, XLogP of 7.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-9-phenylcarbazole is sourced from PubChem (CID 118335086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).