9,11,11-trimethyl-5H-indeno[1,2-b]carbazole

C22H19N — CID 139479961

IUPAC9,11,11-trimethyl-5H-indeno[1,2-b]carbazole
SMILESCc1ccc2c(c1)C(C)(C)c1cc3c(cc1-2)[nH]c1ccccc13
InChIInChI=1S/C22H19N/c1-13-8-9-14-16-12-21-17(15-6-4-5-7-20(15)23-21)11-19(16)22(2,3)18(14)10-13/h4-12,23H,1-3H3
InChIKeyYTZBRFKTYSPQSR-UHFFFAOYSA-N
MW297.40 g/mol
LogP5.94
Rot. Bonds

About 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole

9,11,11-trimethyl-5H-indeno[1,2-b]carbazole (PubChem CID 139479961) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole.

Molecular Properties

Compound Name9,11,11-trimethyl-5H-indeno[1,2-b]carbazole
PubChem CID139479961
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC Name9,11,11-trimethyl-5H-indeno[1,2-b]carbazole
SMILESCc1ccc2c(c1)C(C)(C)c1cc3c(cc1-2)[nH]c1ccccc13
InChIInChI=1S/C22H19N/c1-13-8-9-14-16-12-21-17(15-6-4-5-7-20(15)23-21)11-19(16)22(2,3)18(14)10-13/h4-12,23H,1-3H3
InChIKeyYTZBRFKTYSPQSR-UHFFFAOYSA-N
XLogP5.94
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.40
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

15,15-dimethyl-5-azaheptacyclo[14.12.0.02,14.04,12.06,11.018,27.020,25]octacosa-1(28),2(14),3,6,8,10,12,16,18(27),20,22,24-dodecaene-19,26-dione
CID 70798463
2-(9,9-dimethylfluoren-2-yl)-9H-carbazole
CID 126651978
spiro[5H-indeno[1,2-b]carbazole-11,9'-fluorene]
CID 67472219
2,7,9,9-tetramethylfluorene
CID 22951928
11,11,19,19-tetramethyl-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5,7,9,13,16,18(26),20,22,24-dodecaene
CID 66805182
7,7,9-trimethylfluoreno[2,3-b][1]benzothiole
CID 129267057
2,6,9,9-tetramethylfluorene
CID 23527438
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
8-methyl-5H-benzo[b]carbazole
CID 154982200
7,7,9-trimethylfluoreno[2,3-b][1]benzofuran
CID 129267055
9,11,11-trimethyl-5-phenylindeno[1,2-b]carbazole
CID 71250183
spiro[5H-indeno[2,1-b]carbazole-7,9'-fluorene]
CID 66804950

Frequently Asked Questions

What is the IUPAC name of 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole?
The IUPAC name of 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole (CID 139479961) is 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole.
What is the SMILES notation for 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole?
The canonical SMILES for 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole is Cc1ccc2c(c1)C(C)(C)c1cc3c(cc1-2)[nH]c1ccccc13.
What is the InChIKey of 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole?
The InChIKey is YTZBRFKTYSPQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-13-8-9-14-16-12-21-17(15-6-4-5-7-20(15)23-21)11-19(16)22(2,3)18(14)10-13/h4-12,23H,1-3H3.
What are the key properties of 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole?
9,11,11-trimethyl-5H-indeno[1,2-b]carbazole has a molecular weight of 297.40 g/mol, XLogP of 5.94, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,11,11-trimethyl-5H-indeno[1,2-b]carbazole is sourced from PubChem (CID 139479961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).