5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one

C17H11F3N2O — CID 71574153

IUPAC5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one
SMILESCn1c2ccc(C(F)(F)F)cc2c(=O)c2c3ccccc3[nH]c21
InChIInChI=1S/C17H11F3N2O/c1-22-13-7-6-9(17(18,19)20)8-11(13)15(23)14-10-4-2-3-5-12(10)21-16(14)22/h2-8,21H,1H3
InChIKeyJHAOOVBSVBVYCL-UHFFFAOYSA-N
MW316.28 g/mol
LogP4.19
Rot. Bonds

About 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one

5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one (PubChem CID 71574153) has the molecular formula C17H11F3N2O and a molecular weight of 316.28 g/mol. Its IUPAC name is 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one.

Molecular Properties

Compound Name5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one
PubChem CID71574153
Molecular FormulaC17H11F3N2O
Molecular Weight316.28 g/mol
Exact Mass316.08
IUPAC Name5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one
SMILESCn1c2ccc(C(F)(F)F)cc2c(=O)c2c3ccccc3[nH]c21
InChIInChI=1S/C17H11F3N2O/c1-22-13-7-6-9(17(18,19)20)8-11(13)15(23)14-10-4-2-3-5-12(10)21-16(14)22/h2-8,21H,1H3
InChIKeyJHAOOVBSVBVYCL-UHFFFAOYSA-N
XLogP4.19
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.28
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one?
The IUPAC name of 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one (CID 71574153) is 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one.
What is the SMILES notation for 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one?
The canonical SMILES for 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one is Cn1c2ccc(C(F)(F)F)cc2c(=O)c2c3ccccc3[nH]c21.
What is the InChIKey of 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one?
The InChIKey is JHAOOVBSVBVYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N2O/c1-22-13-7-6-9(17(18,19)20)8-11(13)15(23)14-10-4-2-3-5-12(10)21-16(14)22/h2-8,21H,1H3.
What are the key properties of 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one?
5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one has a molecular weight of 316.28 g/mol, XLogP of 4.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(trifluoromethyl)-6H-indolo[2,3-b]quinolin-11-one is sourced from PubChem (CID 71574153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).