9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole

C33H24N2 — CID 139517953

IUPAC9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole
SMILESC=CCc1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C33H24N2/c1-2-11-23-20-24(34-30-16-7-3-12-26(30)27-13-4-8-17-31(27)34)22-25(21-23)35-32-18-9-5-14-28(32)29-15-6-10-19-33(29)35/h2-10,12-22H,1,11H2
InChIKeyKOKJNEQTZRUJGN-UHFFFAOYSA-N
MW448.57 g/mol
LogP8.61
Rot. Bonds4

About 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole

9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole (PubChem CID 139517953) has the molecular formula C33H24N2 and a molecular weight of 448.57 g/mol. Its IUPAC name is 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole.

Molecular Properties

Compound Name9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole
PubChem CID139517953
Molecular FormulaC33H24N2
Molecular Weight448.57 g/mol
Exact Mass448.19
IUPAC Name9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole
SMILESC=CCc1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C33H24N2/c1-2-11-23-20-24(34-30-16-7-3-12-26(30)27-13-4-8-17-31(27)34)22-25(21-23)35-32-18-9-5-14-28(32)29-15-6-10-19-33(29)35/h2-10,12-22H,1,11H2
InChIKeyKOKJNEQTZRUJGN-UHFFFAOYSA-N
XLogP8.61
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.57
LogP ≤ 58.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

9-phenyl-3-prop-2-enylcarbazole
CID 123281501
9-[3-[3,5-bis[3,5-di(carbazol-9-yl)phenyl]phenyl]-5-carbazol-9-ylphenyl]carbazole
CID 102341656
9-[3,5-di(carbazol-9-yl)phenyl]carbazole;molecular hydrogen
CID 160506495
9-[3-carbazol-9-yl-5-(3-carbazol-9-yl-5-phenylphenyl)phenyl]carbazole
CID 58769488
9-[3-carbazol-9-yl-5-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 176740225
9-(3-carbazol-9-yl-5-hex-5-enoxyphenyl)carbazole
CID 102040847
9-(3,5-diphenylphenyl)carbazole
CID 86068368
[4-[4-[3,5-di(carbazol-9-yl)phenyl]phenyl]phenyl]-ethenyl-dimethylsilane
CID 59489119
9-[3,5-bis(4-carbazol-9-ylphenyl)phenyl]carbazole;9-[3-carbazol-9-yl-5-(3,5-diphenylphenyl)phenyl]carbazole
CID 165005814
9-[3-(4-bromophenyl)-5-carbazol-9-ylphenyl]carbazole
CID 59413518
9-(3-carbazol-9-yl-5-fluorophenyl)carbazole
CID 59399166
9-(4-ethenyl-3,5-difluorophenyl)carbazole
CID 164577686

Frequently Asked Questions

What is the IUPAC name of 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole?
The IUPAC name of 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole (CID 139517953) is 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole.
What is the SMILES notation for 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole?
The canonical SMILES for 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole is C=CCc1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole?
The InChIKey is KOKJNEQTZRUJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H24N2/c1-2-11-23-20-24(34-30-16-7-3-12-26(30)27-13-4-8-17-31(27)34)22-25(21-23)35-32-18-9-5-14-28(32)29-15-6-10-19-33(29)35/h2-10,12-22H,1,11H2.
What are the key properties of 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole?
9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole has a molecular weight of 448.57 g/mol, XLogP of 8.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-carbazol-9-yl-5-prop-2-enylphenyl)carbazole is sourced from PubChem (CID 139517953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).