6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole

C36H32N2 — CID 122492165

IUPAC6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole
SMILESCc1cc(-c2ccc3c(c2)c2cc(C)ccc2n3C)cc(-c2ccc3c(c2)c2cc(C)cc(C)c2n3C)c1
InChIInChI=1S/C36H32N2/c1-21-7-10-33-29(16-21)30-19-25(8-11-34(30)37(33)5)27-14-23(3)15-28(18-27)26-9-12-35-31(20-26)32-17-22(2)13-24(4)36(32)38(35)6/h7-20H,1-6H3
InChIKeyFHYUHNIAEQBNGN-UHFFFAOYSA-N
MW492.67 g/mol
LogP9.54
Rot. Bonds2

About 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole

6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole (PubChem CID 122492165) has the molecular formula C36H32N2 and a molecular weight of 492.67 g/mol. Its IUPAC name is 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole.

Molecular Properties

Compound Name6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole
PubChem CID122492165
Molecular FormulaC36H32N2
Molecular Weight492.67 g/mol
Exact Mass492.26
IUPAC Name6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole
SMILESCc1cc(-c2ccc3c(c2)c2cc(C)ccc2n3C)cc(-c2ccc3c(c2)c2cc(C)cc(C)c2n3C)c1
InChIInChI=1S/C36H32N2/c1-21-7-10-33-29(16-21)30-19-25(8-11-34(30)37(33)5)27-14-23(3)15-28(18-27)26-9-12-35-31(20-26)32-17-22(2)13-24(4)36(32)38(35)6/h7-20H,1-6H3
InChIKeyFHYUHNIAEQBNGN-UHFFFAOYSA-N
XLogP9.54
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.67
LogP ≤ 59.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,9-dimethyl-6-phenylcarbazole
CID 59499447
2-[3-(6,8-dimethyl-9H-carbazol-2-yl)-5-methylphenyl]-6,9-dimethylcarbazole
CID 122492369
1-bromo-3,6,9-trimethylcarbazole
CID 174908796
2,4,5,12-tetramethyl-9-[2-(trifluoromethyl)phenyl]quinolino[2,3-b]acridine-7,14-dione
CID 138622461
16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
3,6-bis[6-methyl-9-(4-methylphenyl)carbazol-3-yl]-9-(4-methylphenyl)carbazole
CID 59412028
3,6-dimethyl-9-[3-methyl-4-[3-methyl-5-(6-methyl-9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole
CID 118968592
1-methyl-3-[3-methyl-5-(4-methylphenyl)phenyl]-5-(4-methylphenyl)benzene
CID 58892368
11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole
CID 58410457
2-(3,5-dimethylphenyl)-7-methyltriphenylene
CID 158973424
3-[9-[4-(3-methyl-5-phenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-methyl-9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 157292241
9-methylcarbazole;9-methyl-3,6-diphenylcarbazole;9-methyl-3-(2-methylphenyl)carbazole;9-methyl-3-(4-methylphenyl)carbazole;9-methyl-3-phenylcarbazole
CID 157294654

Frequently Asked Questions

What is the IUPAC name of 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole?
The IUPAC name of 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole (CID 122492165) is 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole.
What is the SMILES notation for 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole?
The canonical SMILES for 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole is Cc1cc(-c2ccc3c(c2)c2cc(C)ccc2n3C)cc(-c2ccc3c(c2)c2cc(C)cc(C)c2n3C)c1.
What is the InChIKey of 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole?
The InChIKey is FHYUHNIAEQBNGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32N2/c1-21-7-10-33-29(16-21)30-19-25(8-11-34(30)37(33)5)27-14-23(3)15-28(18-27)26-9-12-35-31(20-26)32-17-22(2)13-24(4)36(32)38(35)6/h7-20H,1-6H3.
What are the key properties of 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole?
6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole has a molecular weight of 492.67 g/mol, XLogP of 9.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(6,9-dimethylcarbazol-3-yl)-5-methylphenyl]-1,3,9-trimethylcarbazole is sourced from PubChem (CID 122492165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).