2,6-dibromo-9-naphthalen-2-ylcarbazole

C22H13Br2N — CID 126674108

IUPAC2,6-dibromo-9-naphthalen-2-ylcarbazole
SMILESBrc1ccc2c(c1)c1ccc(Br)cc1n2-c1ccc2ccccc2c1
InChIInChI=1S/C22H13Br2N/c23-16-7-10-21-20(12-16)19-9-6-17(24)13-22(19)25(21)18-8-5-14-3-1-2-4-15(14)11-18/h1-13H
InChIKeyFQMRHBISAMAGSY-UHFFFAOYSA-N
MW451.16 g/mol
LogP7.46
Rot. Bonds1

About 2,6-dibromo-9-naphthalen-2-ylcarbazole

2,6-dibromo-9-naphthalen-2-ylcarbazole (PubChem CID 126674108) has the molecular formula C22H13Br2N and a molecular weight of 451.16 g/mol. Its IUPAC name is 2,6-dibromo-9-naphthalen-2-ylcarbazole.

Molecular Properties

Compound Name2,6-dibromo-9-naphthalen-2-ylcarbazole
PubChem CID126674108
Molecular FormulaC22H13Br2N
Molecular Weight451.16 g/mol
Exact Mass448.94
IUPAC Name2,6-dibromo-9-naphthalen-2-ylcarbazole
SMILESBrc1ccc2c(c1)c1ccc(Br)cc1n2-c1ccc2ccccc2c1
InChIInChI=1S/C22H13Br2N/c23-16-7-10-21-20(12-16)19-9-6-17(24)13-22(19)25(21)18-8-5-14-3-1-2-4-15(14)11-18/h1-13H
InChIKeyFQMRHBISAMAGSY-UHFFFAOYSA-N
XLogP7.46
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.16
LogP ≤ 57.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9H-carbazole;3,6-dibromo-9-naphthalen-2-ylcarbazole;3,6-di(carbazol-9-yl)-9-naphthalen-2-ylcarbazole
CID 161042085
2-bromo-9-naphthalen-2-ylcarbazole;2-bromo-9-phenylcarbazole;2-bromo-9-(3-phenylphenyl)carbazole;2-bromo-9-(4-phenylphenyl)carbazole
CID 158059699
2-[3-(3-bromophenyl)phenyl]-9-naphthalen-2-ylcarbazole
CID 90216158
2-[4-(3-bromophenyl)phenyl]-9-naphthalen-2-ylcarbazole
CID 118265635
11-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylindolo[3,2-b]carbazole
CID 149025135
2-bromo-9-(9-phenylcarbazol-2-yl)carbazole
CID 167514320
ethane;9-naphthalen-2-yl-3-(9-naphthalen-2-ylcarbazol-3-yl)carbazole
CID 142515451
9-[6-bromo-7-(3-bromo-6-carbazol-9-ylnaphthalen-2-yl)naphthalen-2-yl]carbazole
CID 166033097
3-[4-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9-phenylcarbazole
CID 118919603
9-(6-bromonaphthalen-2-yl)-3,6-ditert-butylcarbazole
CID 138478846
20-(3-bromophenyl)-17-(16-carbazol-9-yl-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-dodecaen-20-yl)-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 172522364
3,6-dinaphthalen-2-yl-9-phenanthren-2-ylcarbazole
CID 177074724

Frequently Asked Questions

What is the IUPAC name of 2,6-dibromo-9-naphthalen-2-ylcarbazole?
The IUPAC name of 2,6-dibromo-9-naphthalen-2-ylcarbazole (CID 126674108) is 2,6-dibromo-9-naphthalen-2-ylcarbazole.
What is the SMILES notation for 2,6-dibromo-9-naphthalen-2-ylcarbazole?
The canonical SMILES for 2,6-dibromo-9-naphthalen-2-ylcarbazole is Brc1ccc2c(c1)c1ccc(Br)cc1n2-c1ccc2ccccc2c1.
What is the InChIKey of 2,6-dibromo-9-naphthalen-2-ylcarbazole?
The InChIKey is FQMRHBISAMAGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13Br2N/c23-16-7-10-21-20(12-16)19-9-6-17(24)13-22(19)25(21)18-8-5-14-3-1-2-4-15(14)11-18/h1-13H.
What are the key properties of 2,6-dibromo-9-naphthalen-2-ylcarbazole?
2,6-dibromo-9-naphthalen-2-ylcarbazole has a molecular weight of 451.16 g/mol, XLogP of 7.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromo-9-naphthalen-2-ylcarbazole is sourced from PubChem (CID 126674108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).