3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole

C34H28N2 — CID 59306787

IUPAC3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole
SMILESCC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)c1
InChIInChI=1S/C34H28N2/c1-22(2)18-23-8-7-9-26(19-23)36-33-13-6-4-11-28(33)30-21-25(15-17-34(30)36)24-14-16-32-29(20-24)27-10-3-5-12-31(27)35-32/h3-17,19-22,35H,18H2,1-2H3
InChIKeyTUJUSZNQKKWOIM-UHFFFAOYSA-N
MW464.61 g/mol
LogP9.28
Rot. Bonds4

About 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole

3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole (PubChem CID 59306787) has the molecular formula C34H28N2 and a molecular weight of 464.61 g/mol. Its IUPAC name is 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole.

Molecular Properties

Compound Name3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole
PubChem CID59306787
Molecular FormulaC34H28N2
Molecular Weight464.61 g/mol
Exact Mass464.23
IUPAC Name3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole
SMILESCC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)c1
InChIInChI=1S/C34H28N2/c1-22(2)18-23-8-7-9-26(19-23)36-33-13-6-4-11-28(33)30-21-25(15-17-34(30)36)24-14-16-32-29(20-24)27-10-3-5-12-31(27)35-32/h3-17,19-22,35H,18H2,1-2H3
InChIKeyTUJUSZNQKKWOIM-UHFFFAOYSA-N
XLogP9.28
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.61
LogP ≤ 59.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9H-carbazole;9-[3-(2-methylbutyl)phenyl]-3-(3-methylphenyl)carbazole
CID 91181836
3,6-bis[9-[3-(2-methylpropyl)phenyl]carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59307104
3-(9H-carbazol-2-yl)-9-(3-phenylphenyl)carbazole
CID 122652205
3-(9-phenylcarbazol-3-yl)-6-[4-(9-phenylcarbazol-3-yl)phenyl]-9H-carbazole
CID 59307187
3-[4-(2-methylpropyl)phenyl]-9H-carbazole
CID 66615207
(Z)-but-2-ene;3-(9H-carbazol-3-yl)-9-phenylcarbazole
CID 145055834
2-(3-carbazol-9-ylphenyl)-9H-carbazole
CID 118378581
3-carbazol-9-yl-9-[9-[9-[9-[9-[9-(9H-carbazol-3-yl)carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25208834
3-(2-methylpropyl)-9-phenyl-6-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]carbazole
CID 59306914
9-[3-[3,6-bis(3-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]-3,6-bis(3-carbazol-9-ylphenyl)carbazole
CID 153162679
3-(9H-carbazol-3-yl)-9-(2-propan-2-ylphenyl)carbazole
CID 59306791
3-(9H-carbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118699073

Frequently Asked Questions

What is the IUPAC name of 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole?
The IUPAC name of 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole (CID 59306787) is 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole.
What is the SMILES notation for 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole?
The canonical SMILES for 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole is CC(C)Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5[nH]c6ccccc6c5c4)ccc32)c1.
What is the InChIKey of 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole?
The InChIKey is TUJUSZNQKKWOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N2/c1-22(2)18-23-8-7-9-26(19-23)36-33-13-6-4-11-28(33)30-21-25(15-17-34(30)36)24-14-16-32-29(20-24)27-10-3-5-12-31(27)35-32/h3-17,19-22,35H,18H2,1-2H3.
What are the key properties of 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole?
3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole has a molecular weight of 464.61 g/mol, XLogP of 9.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-carbazol-3-yl)-9-[3-(2-methylpropyl)phenyl]carbazole is sourced from PubChem (CID 59306787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).