6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one

C20H16N2O — CID 100947542

IUPAC6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one
SMILESCC12CC3=Nc4ccccc4C3(C)C(=O)C1=Nc1ccccc12
InChIInChI=1S/C20H16N2O/c1-19-11-16-20(2,13-8-4-6-10-15(13)21-16)18(23)17(19)22-14-9-5-3-7-12(14)19/h3-10H,11H2,1-2H3
InChIKeyLNFFPKUWKBUETQ-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.05
Rot. Bonds

About 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one

6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one (PubChem CID 100947542) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one.

Molecular Properties

Compound Name6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one
PubChem CID100947542
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one
SMILESCC12CC3=Nc4ccccc4C3(C)C(=O)C1=Nc1ccccc12
InChIInChI=1S/C20H16N2O/c1-19-11-16-20(2,13-8-4-6-10-15(13)21-16)18(23)17(19)22-14-9-5-3-7-12(14)19/h3-10H,11H2,1-2H3
InChIKeyLNFFPKUWKBUETQ-UHFFFAOYSA-N
XLogP4.05
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(8bS)-8b-methyl-1H-thieno[2,3-b]indol-2-one
CID 125489436
3,3-dimethyl-2-phenylindole;ethane
CID 90996712
2,3-dimethylindole-3-carbaldehyde
CID 174957699
(E)-2-(3,3-dimethylindol-2-yl)-3-hydroxyprop-2-enal
CID 139068970
(4,4-dimethyl-3H-quinolin-2-yl)hydrazine
CID 154101946
bis(2,3,3-trimethylindole);dihydrobromide
CID 175169971
4,4-dimethyl-2-methylidene-3H-naphthalen-1-one
CID 57081376
1-(3,3-dimethylindol-2-yl)ethanone
CID 2752622
(4E)-3-hydroxy-2-[(Z)-(3-methyl-3-phenyl-1H-indol-2-ylidene)methyl]-4-[(3-methyl-3-phenylindol-2-yl)methylidene]cyclobut-2-en-1-one
CID 177492950
3,3-dimethyl-2-phenylindole;iridium
CID 21014664
(4Z)-2-(10a-methyl-7,8,9,10-tetrahydro-5H-cyclohepta[b]indol-6-yl)-4-(10a-methyl-7,8,9,10-tetrahydrocyclohepta[b]indol-6-ylidene)-3-hydroxycyclobut-2-en-1-one
CID 153489099
2'-[4-(trifluoromethyl)phenyl]spiro[cyclopentane-1,3'-indole]
CID 122374112

Frequently Asked Questions

What is the IUPAC name of 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one?
The IUPAC name of 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one (CID 100947542) is 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one.
What is the SMILES notation for 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one?
The canonical SMILES for 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one is CC12CC3=Nc4ccccc4C3(C)C(=O)C1=Nc1ccccc12.
What is the InChIKey of 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one?
The InChIKey is LNFFPKUWKBUETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-19-11-16-20(2,13-8-4-6-10-15(13)21-16)18(23)17(19)22-14-9-5-3-7-12(14)19/h3-10H,11H2,1-2H3.
What are the key properties of 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one?
6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one has a molecular weight of 300.36 g/mol, XLogP of 4.05, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6a,12a-dimethyl-6H-indolo[3,2-b]carbazol-12-one is sourced from PubChem (CID 100947542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).