5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione

C18H15NO3 — CID 73353970

IUPAC5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione
SMILESCC(C)n1c2c(c3c1-c1ccccc1C3=O)C(=O)CCC2=O
InChIInChI=1S/C18H15NO3/c1-9(2)19-16-10-5-3-4-6-11(10)18(22)15(16)14-12(20)7-8-13(21)17(14)19/h3-6,9H,7-8H2,1-2H3
InChIKeyTVJRAGSLXXBXQQ-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.44
Rot. Bonds1

About 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione

5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione (PubChem CID 73353970) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione.

Molecular Properties

Compound Name5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione
PubChem CID73353970
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione
SMILESCC(C)n1c2c(c3c1-c1ccccc1C3=O)C(=O)CCC2=O
InChIInChI=1S/C18H15NO3/c1-9(2)19-16-10-5-3-4-6-11(10)18(22)15(16)14-12(20)7-8-13(21)17(14)19/h3-6,9H,7-8H2,1-2H3
InChIKeyTVJRAGSLXXBXQQ-UHFFFAOYSA-N
XLogP3.44
TPSA56.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-propan-2-yl-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 24764502
5-(2-phenylethyl)-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 24826109
7-methyl-5-(2-phenylethyl)-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 66637000
5(3-Phenylpropyl)-5,7,8-tetrahydroindeno[1,2-b]indol-9,10-dione
CID 24204512
5-benzyl-7-phenyl-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 406584
7-methyl-5-propan-2-yl-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 66636984
5-(1-phenylethyl)-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 24826110
7-phenyl-5-(2-phenylethyl)-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 101913604
8,8-Dibenzyl-5-propan-2-yl-6,7-dihydroindeno[1,2-b]indole-9,10-dione
CID 118719585
5-phenyl-7,8-dihydro-6H-indeno[1,2-b]indole-9,10-dione
CID 24826111
5-Benzylindeno[1,2-b]indole-6,9,10-trione
CID 24826192
5-Benzyl-5,7,8-tetrahydro-indeno[1,2-b]indole-9,10-dione
CID 406017

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione?
The IUPAC name of 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione (CID 73353970) is 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione.
What is the SMILES notation for 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione?
The canonical SMILES for 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione is CC(C)n1c2c(c3c1-c1ccccc1C3=O)C(=O)CCC2=O.
What is the InChIKey of 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione?
The InChIKey is TVJRAGSLXXBXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-9(2)19-16-10-5-3-4-6-11(10)18(22)15(16)14-12(20)7-8-13(21)17(14)19/h3-6,9H,7-8H2,1-2H3.
What are the key properties of 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione?
5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione has a molecular weight of 293.32 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-7,8-dihydroindeno[1,2-b]indole-6,9,10-trione is sourced from PubChem (CID 73353970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).