5,5,6,6-tetramethyl-11H-benzo[a]carbazole

C20H21N — CID 3770048

IUPAC5,5,6,6-tetramethyl-11H-benzo[a]carbazole
SMILESCC1(C)c2ccccc2-c2[nH]c3ccccc3c2C1(C)C
InChIInChI=1S/C20H21N/c1-19(2)15-11-7-5-9-13(15)18-17(20(19,3)4)14-10-6-8-12-16(14)21-18/h5-12,21H,1-4H3
InChIKeyLFIPFXXMZZBSSJ-UHFFFAOYSA-N
MW275.39 g/mol
LogP5.40
Rot. Bonds

About 5,5,6,6-tetramethyl-11H-benzo[a]carbazole

5,5,6,6-tetramethyl-11H-benzo[a]carbazole (PubChem CID 3770048) has the molecular formula C20H21N and a molecular weight of 275.39 g/mol. Its IUPAC name is 5,5,6,6-tetramethyl-11H-benzo[a]carbazole.

Molecular Properties

Compound Name5,5,6,6-tetramethyl-11H-benzo[a]carbazole
PubChem CID3770048
Molecular FormulaC20H21N
Molecular Weight275.39 g/mol
Exact Mass275.17
IUPAC Name5,5,6,6-tetramethyl-11H-benzo[a]carbazole
SMILESCC1(C)c2ccccc2-c2[nH]c3ccccc3c2C1(C)C
InChIInChI=1S/C20H21N/c1-19(2)15-11-7-5-9-13(15)18-17(20(19,3)4)14-10-6-8-12-16(14)21-18/h5-12,21H,1-4H3
InChIKeyLFIPFXXMZZBSSJ-UHFFFAOYSA-N
XLogP5.40
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.39
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

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2-(3,3,4,4-tetramethylisoquinolin-1-yl)-1H-quinolin-4-one
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10,10-dimethyl-9-(2-nitrophenyl)-5H-indeno[1,2-b]indole
CID 90257397
19,19-dimethyl-9-azaheptacyclo[15.11.0.02,10.03,8.011,16.018,26.020,25]octacosa-1(17),2(10),3,5,7,11,13,15,18(26),20,22,24,27-tridecaene
CID 126738032
2-(2-fluorophenyl)-2-[2-(2-fluorophenyl)-1H-indol-3-yl]-1H-indol-3-one
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spiro[11H-indeno[2,1-a]carbazole-12,9'-fluorene]
CID 118343947

Frequently Asked Questions

What is the IUPAC name of 5,5,6,6-tetramethyl-11H-benzo[a]carbazole?
The IUPAC name of 5,5,6,6-tetramethyl-11H-benzo[a]carbazole (CID 3770048) is 5,5,6,6-tetramethyl-11H-benzo[a]carbazole.
What is the SMILES notation for 5,5,6,6-tetramethyl-11H-benzo[a]carbazole?
The canonical SMILES for 5,5,6,6-tetramethyl-11H-benzo[a]carbazole is CC1(C)c2ccccc2-c2[nH]c3ccccc3c2C1(C)C.
What is the InChIKey of 5,5,6,6-tetramethyl-11H-benzo[a]carbazole?
The InChIKey is LFIPFXXMZZBSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N/c1-19(2)15-11-7-5-9-13(15)18-17(20(19,3)4)14-10-6-8-12-16(14)21-18/h5-12,21H,1-4H3.
What are the key properties of 5,5,6,6-tetramethyl-11H-benzo[a]carbazole?
5,5,6,6-tetramethyl-11H-benzo[a]carbazole has a molecular weight of 275.39 g/mol, XLogP of 5.40, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,6,6-tetramethyl-11H-benzo[a]carbazole is sourced from PubChem (CID 3770048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).