12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole

C33H23NO — CID 118502345

IUPAC12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole
SMILESCC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3ccc4c(c3)oc3ccccc34)c21
InChIInChI=1S/C33H23NO/c1-33(2)26-12-6-3-11-25(26)31-27(33)18-17-24-21-9-4-7-13-28(21)34(32(24)31)20-15-16-23-22-10-5-8-14-29(22)35-30(23)19-20/h3-19H,1-2H3
InChIKeyAFRNRECSANMQKP-UHFFFAOYSA-N
MW449.55 g/mol
LogP8.99
Rot. Bonds1

About 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole

12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole (PubChem CID 118502345) has the molecular formula C33H23NO and a molecular weight of 449.55 g/mol. Its IUPAC name is 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole
PubChem CID118502345
Molecular FormulaC33H23NO
Molecular Weight449.55 g/mol
Exact Mass449.18
IUPAC Name12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole
SMILESCC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3ccc4c(c3)oc3ccccc34)c21
InChIInChI=1S/C33H23NO/c1-33(2)26-12-6-3-11-25(26)31-27(33)18-17-24-21-9-4-7-13-28(21)34(32(24)31)20-15-16-23-22-10-5-8-14-29(22)35-30(23)19-20/h3-19H,1-2H3
InChIKeyAFRNRECSANMQKP-UHFFFAOYSA-N
XLogP8.99
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.55
LogP ≤ 58.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7,7-dimethyl-12-triphenylen-2-ylindeno[1,2-a]carbazole
CID 90441170
12'-dibenzofuran-2-ylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 90253710
12-[3-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 169014822
12-[4-(9,9-dimethylfluoren-3-yl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 118502376
9-dibenzofuran-2-yl-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-dibenzofuran-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzofuran-2-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzofuran-2-yl-12,12-dimethylindeno[1,2-c]carbazole
CID 159024447
12-dibenzofuran-2-yl-5-(9,9-dimethylfluoren-2-yl)indolo[3,2-c]carbazole
CID 122595550
11-[4-dibenzofuran-3-yl-6-(9,9-dimethylfluoren-4-yl)-1,3,5-triazin-2-yl]-26,26-dimethyl-14-azaheptacyclo[12.10.1.13,24.02,7.08,13.015,20.021,25]hexacosa-1(24),2(7),3,5,8(13),9,11,15,17,19,21(25),22-dodecaene
CID 169058057
12-[3-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 162362960
12-[4-[2,6-bis[3-(7,7-dimethylindeno[1,2-a]carbazol-12-yl)phenyl]pyrimidin-4-yl]phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 126630670
12-[4-(4,6-diphenyl-1,3,5-triazinan-2-yl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 121343632
17,21-bis(9,9-dimethylfluoren-3-yl)-8,30-dioxa-17,21-diazanonacyclo[18.14.0.03,18.04,16.07,15.09,14.022,34.023,31.024,29]tetratriaconta-1(20),2,4(16),5,7(15),9,11,13,18,22(34),23(31),24,26,28,32-pentadecaene
CID 163417489
3-dibenzofuran-3-yl-15-phenyl-3,15-diazahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4,6,8,11,14(22),16,18,20,23-undecaene
CID 122465434

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole?
The IUPAC name of 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole (CID 118502345) is 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole.
What is the SMILES notation for 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole?
The canonical SMILES for 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole is CC1(C)c2ccccc2-c2c1ccc1c3ccccc3n(-c3ccc4c(c3)oc3ccccc34)c21.
What is the InChIKey of 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole?
The InChIKey is AFRNRECSANMQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23NO/c1-33(2)26-12-6-3-11-25(26)31-27(33)18-17-24-21-9-4-7-13-28(21)34(32(24)31)20-15-16-23-22-10-5-8-14-29(22)35-30(23)19-20/h3-19H,1-2H3.
What are the key properties of 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole?
12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole has a molecular weight of 449.55 g/mol, XLogP of 8.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-3-yl-7,7-dimethylindeno[1,2-a]carbazole is sourced from PubChem (CID 118502345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).