4-iodo-9-phenylcarbazole

C18H12IN — CID 126592391

IUPAC4-iodo-9-phenylcarbazole
SMILESIc1cccc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C18H12IN/c19-15-10-6-12-17-18(15)14-9-4-5-11-16(14)20(17)13-7-2-1-3-8-13/h1-12H
InChIKeyUDQJADOACUPXCN-UHFFFAOYSA-N
MW369.21 g/mol
LogP5.39
Rot. Bonds1

About 4-iodo-9-phenylcarbazole

4-iodo-9-phenylcarbazole (PubChem CID 126592391) has the molecular formula C18H12IN and a molecular weight of 369.21 g/mol. Its IUPAC name is 4-iodo-9-phenylcarbazole.

Molecular Properties

Compound Name4-iodo-9-phenylcarbazole
PubChem CID126592391
Molecular FormulaC18H12IN
Molecular Weight369.21 g/mol
Exact Mass369.00
IUPAC Name4-iodo-9-phenylcarbazole
SMILESIc1cccc2c1c1ccccc1n2-c1ccccc1
InChIInChI=1S/C18H12IN/c19-15-10-6-12-17-18(15)14-9-4-5-11-16(14)20(17)13-7-2-1-3-8-13/h1-12H
InChIKeyUDQJADOACUPXCN-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'}

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Related Compounds

9-phenyl-14-[10-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)anthracen-9-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170394033
9-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 134168669
4-(4-fluoranthen-3-ylnaphthalen-1-yl)-9-phenylcarbazole
CID 122434619
(9-phenylcarbazol-4-yl)boronic acid
CID 90057429
9-phenyl-4-pyrrol-1-ylcarbazole
CID 168863070
CID 148804353
CID 148804353
5,12-diphenylindolo[3,2-c]carbazole
CID 22105108
9-phenyl-4-[10-(9-phenylcarbazol-4-yl)perylen-3-yl]carbazole
CID 171428659
2-(9-phenylcarbazol-4-yl)acetic acid
CID 154200316
ethane;(9-phenylcarbazol-4-yl)boronic acid
CID 178110282
9,15-diphenyl-9,15-diazahexacyclo[11.11.0.02,10.03,8.014,22.016,21]tetracosa-1(13),2(10),3,5,7,11,14(22),16,18,20,23-undecaene
CID 122464932
12,18-diphenyl-15-(9-phenylcarbazol-4-yl)-12,15,18-triazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.019,24]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),19,21,23,26-dodecaene
CID 174349441

Frequently Asked Questions

What is the IUPAC name of 4-iodo-9-phenylcarbazole?
The IUPAC name of 4-iodo-9-phenylcarbazole (CID 126592391) is 4-iodo-9-phenylcarbazole.
What is the SMILES notation for 4-iodo-9-phenylcarbazole?
The canonical SMILES for 4-iodo-9-phenylcarbazole is Ic1cccc2c1c1ccccc1n2-c1ccccc1.
What is the InChIKey of 4-iodo-9-phenylcarbazole?
The InChIKey is UDQJADOACUPXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12IN/c19-15-10-6-12-17-18(15)14-9-4-5-11-16(14)20(17)13-7-2-1-3-8-13/h1-12H.
What are the key properties of 4-iodo-9-phenylcarbazole?
4-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 4-iodo-9-phenylcarbazole is sourced from PubChem (CID 126592391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).