3-iodo-6-methyl-9-phenylcarbazole

C19H14IN — CID 121336182

IUPAC3-iodo-6-methyl-9-phenylcarbazole
SMILESCc1ccc2c(c1)c1cc(I)ccc1n2-c1ccccc1
InChIInChI=1S/C19H14IN/c1-13-7-9-18-16(11-13)17-12-14(20)8-10-19(17)21(18)15-5-3-2-4-6-15/h2-12H,1H3
InChIKeyIQTHLHUERGBMJM-UHFFFAOYSA-N
MW383.23 g/mol
LogP5.70
Rot. Bonds1

About 3-iodo-6-methyl-9-phenylcarbazole

3-iodo-6-methyl-9-phenylcarbazole (PubChem CID 121336182) has the molecular formula C19H14IN and a molecular weight of 383.23 g/mol. Its IUPAC name is 3-iodo-6-methyl-9-phenylcarbazole.

Molecular Properties

Compound Name3-iodo-6-methyl-9-phenylcarbazole
PubChem CID121336182
Molecular FormulaC19H14IN
Molecular Weight383.23 g/mol
Exact Mass383.02
IUPAC Name3-iodo-6-methyl-9-phenylcarbazole
SMILESCc1ccc2c(c1)c1cc(I)ccc1n2-c1ccccc1
InChIInChI=1S/C19H14IN/c1-13-7-9-18-16(11-13)17-12-14(20)8-10-19(17)21(18)15-5-3-2-4-6-15/h2-12H,1H3
InChIKeyIQTHLHUERGBMJM-UHFFFAOYSA-N
XLogP5.70
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.23
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-iodo-9-phenylcarbazole
CID 11810740
9-(4-iodophenyl)-3,6-dimethylcarbazole
CID 141350753
3,6-bis(3-iodocarbazol-9-yl)-9-phenylcarbazole
CID 163545448
2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159508303
6-methyl-9-phenylcarbazole-3-thiol
CID 143213291
3-iodo-9-(4-iodophenyl)carbazole
CID 139783630
2-methyl-7-(4-methylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 71140488
6-methyl-N,9-diphenylcarbazol-3-amine
CID 58807692
3-carbazol-9-yl-6-methyl-9-phenylcarbazole;2-(3-methylcarbazol-9-yl)-9-phenylcarbazole
CID 158584509
3-(4-methylphenyl)-6,9-diphenylcarbazole
CID 90290564
2-methyl-9-phenylcarbazole
CID 59552741
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075

Frequently Asked Questions

What is the IUPAC name of 3-iodo-6-methyl-9-phenylcarbazole?
The IUPAC name of 3-iodo-6-methyl-9-phenylcarbazole (CID 121336182) is 3-iodo-6-methyl-9-phenylcarbazole.
What is the SMILES notation for 3-iodo-6-methyl-9-phenylcarbazole?
The canonical SMILES for 3-iodo-6-methyl-9-phenylcarbazole is Cc1ccc2c(c1)c1cc(I)ccc1n2-c1ccccc1.
What is the InChIKey of 3-iodo-6-methyl-9-phenylcarbazole?
The InChIKey is IQTHLHUERGBMJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14IN/c1-13-7-9-18-16(11-13)17-12-14(20)8-10-19(17)21(18)15-5-3-2-4-6-15/h2-12H,1H3.
What are the key properties of 3-iodo-6-methyl-9-phenylcarbazole?
3-iodo-6-methyl-9-phenylcarbazole has a molecular weight of 383.23 g/mol, XLogP of 5.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-6-methyl-9-phenylcarbazole is sourced from PubChem (CID 121336182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).