3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole

C34H28N2 — CID 59412024

IUPAC3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole
SMILESCc1ccc(-n2c3ccc(C)cc3c3cc(-n4c5ccc(C)cc5c5cc(C)ccc54)ccc32)cc1
InChIInChI=1S/C34H28N2/c1-21-5-10-25(11-6-21)35-31-13-7-24(4)19-29(31)30-20-26(12-16-34(30)35)36-32-14-8-22(2)17-27(32)28-18-23(3)9-15-33(28)36/h5-20H,1-4H3
InChIKeyFXROOQRZJRCTDW-UHFFFAOYSA-N
MW464.61 g/mol
LogP9.11
Rot. Bonds2

About 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole

3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole (PubChem CID 59412024) has the molecular formula C34H28N2 and a molecular weight of 464.61 g/mol. Its IUPAC name is 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole.

Molecular Properties

Compound Name3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole
PubChem CID59412024
Molecular FormulaC34H28N2
Molecular Weight464.61 g/mol
Exact Mass464.23
IUPAC Name3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole
SMILESCc1ccc(-n2c3ccc(C)cc3c3cc(-n4c5ccc(C)cc5c5cc(C)ccc54)ccc32)cc1
InChIInChI=1S/C34H28N2/c1-21-5-10-25(11-6-21)35-31-13-7-24(4)19-29(31)30-20-26(12-16-34(30)35)36-32-14-8-22(2)17-27(32)28-18-23(3)9-15-33(28)36/h5-20H,1-4H3
InChIKeyFXROOQRZJRCTDW-UHFFFAOYSA-N
XLogP9.11
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.61
LogP ≤ 59.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-bis[6-methyl-9-(4-methylphenyl)carbazol-3-yl]-9-(4-methylphenyl)carbazole
CID 59412028
9-(4-iodophenyl)-3,6-dimethylcarbazole
CID 141350753
3,6-dimethyl-9-[4-[3-[3-(4-methylphenyl)phenyl]phenyl]phenyl]carbazole
CID 118488392
2,9-dimethyl-5-[8-methyl-5,11-bis(4-methylphenyl)indolo[3,2-b]carbazol-2-yl]-12-(4-methylphenyl)indolo[3,2-c]carbazole
CID 90195030
9-[4-[(E)-2-[4-[4-[(E)-2-[4-(3,6-dimethylcarbazol-9-yl)phenyl]ethenyl]phenyl]phenyl]ethenyl]phenyl]-3,6-dimethylcarbazole
CID 140923989
3-methyl-9-(4-methylphenyl)-6-[9-(4-methylphenyl)-6-[9-(4-methylphenyl)carbazol-3-yl]carbazol-3-yl]carbazole
CID 70866701
3-carbazol-9-yl-6-methyl-9-phenylcarbazole;2-(3-methylcarbazol-9-yl)-9-phenylcarbazole
CID 158584509
9-(3,5-dimethylphenyl)-3,6-dimethylcarbazole
CID 138699297
3,6-bis(3,6-dimethylcarbazol-9-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole
CID 162480016
3-methyl-6-[6-methyl-9-(3-methylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 174182038
2-methyl-7-(4-methylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 71140488
6-methyl-2-(9-phenylcarbazol-3-yl)-9-triphenylen-2-ylcarbazole
CID 118330173

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole?
The IUPAC name of 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole (CID 59412024) is 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole.
What is the SMILES notation for 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole?
The canonical SMILES for 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole is Cc1ccc(-n2c3ccc(C)cc3c3cc(-n4c5ccc(C)cc5c5cc(C)ccc54)ccc32)cc1.
What is the InChIKey of 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole?
The InChIKey is FXROOQRZJRCTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N2/c1-21-5-10-25(11-6-21)35-31-13-7-24(4)19-29(31)30-20-26(12-16-34(30)35)36-32-14-8-22(2)17-27(32)28-18-23(3)9-15-33(28)36/h5-20H,1-4H3.
What are the key properties of 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole?
3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole has a molecular weight of 464.61 g/mol, XLogP of 9.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-9-[6-methyl-9-(4-methylphenyl)carbazol-3-yl]carbazole is sourced from PubChem (CID 59412024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).