3-iodo-9-phenylcarbazole

C18H12IN — CID 11810740

IUPAC3-iodo-9-phenylcarbazole
SMILESIc1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C18H12IN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H
InChIKeyPJUAIXDOXUXBDR-UHFFFAOYSA-N
MW369.21 g/mol
LogP5.39
Rot. Bonds1

About 3-iodo-9-phenylcarbazole

3-iodo-9-phenylcarbazole (PubChem CID 11810740) has the molecular formula C18H12IN and a molecular weight of 369.21 g/mol. Its IUPAC name is 3-iodo-9-phenylcarbazole.

Molecular Properties

Compound Name3-iodo-9-phenylcarbazole
PubChem CID11810740
Molecular FormulaC18H12IN
Molecular Weight369.21 g/mol
Exact Mass369.00
IUPAC Name3-iodo-9-phenylcarbazole
SMILESIc1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C18H12IN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H
InChIKeyPJUAIXDOXUXBDR-UHFFFAOYSA-N
XLogP5.39
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.21
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-iodo-9-phenylcarbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,6-bis(3-iodocarbazol-9-yl)-9-phenylcarbazole
CID 163545448
3-iodo-9-(4-iodophenyl)carbazole
CID 139783630
3-iodo-6-methyl-9-phenylcarbazole
CID 121336182
3-[4-(8-iododibenzofuran-2-yl)phenyl]-9-phenylcarbazole
CID 58536445
3-iodo-9-pyridin-3-ylcarbazole
CID 156633056
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
9-(4-iodophenyl)-3-phenylcarbazole
CID 167227803
3-carbazol-9-yl-9-phenylcarbazole;ethane
CID 145117169
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440
2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
CID 118504684
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483

Frequently Asked Questions

What is the IUPAC name of 3-iodo-9-phenylcarbazole?
The IUPAC name of 3-iodo-9-phenylcarbazole (CID 11810740) is 3-iodo-9-phenylcarbazole.
What is the SMILES notation for 3-iodo-9-phenylcarbazole?
The canonical SMILES for 3-iodo-9-phenylcarbazole is Ic1ccc2c(c1)c1ccccc1n2-c1ccccc1.
What is the InChIKey of 3-iodo-9-phenylcarbazole?
The InChIKey is PJUAIXDOXUXBDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12IN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H.
What are the key properties of 3-iodo-9-phenylcarbazole?
3-iodo-9-phenylcarbazole has a molecular weight of 369.21 g/mol, XLogP of 5.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-9-phenylcarbazole is sourced from PubChem (CID 11810740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).