1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one

C21H24N2OSi — CID 5459414

IUPAC1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one
SMILESCC(C)c1cccc2nc3c(c([Si](C)(C)C)c12)Cn1c-3cccc1=O
InChIInChI=1S/C21H24N2OSi/c1-13(2)14-8-6-9-16-19(14)21(25(3,4)5)15-12-23-17(20(15)22-16)10-7-11-18(23)24/h6-11,13H,12H2,1-5H3
InChIKeyNGSSXOWPPRNPPF-UHFFFAOYSA-N
MW348.52 g/mol
LogP4.09
Rot. Bonds2

About 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one

1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one (PubChem CID 5459414) has the molecular formula C21H24N2OSi and a molecular weight of 348.52 g/mol. Its IUPAC name is 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one.

Molecular Properties

Compound Name1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one
PubChem CID5459414
Molecular FormulaC21H24N2OSi
Molecular Weight348.52 g/mol
Exact Mass348.17
IUPAC Name1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one
SMILESCC(C)c1cccc2nc3c(c([Si](C)(C)C)c12)Cn1c-3cccc1=O
InChIInChI=1S/C21H24N2OSi/c1-13(2)14-8-6-9-16-19(14)21(25(3,4)5)15-12-23-17(20(15)22-16)10-7-11-18(23)24/h6-11,13H,12H2,1-5H3
InChIKeyNGSSXOWPPRNPPF-UHFFFAOYSA-N
XLogP4.09
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.52
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-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 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one?
The IUPAC name of 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one (CID 5459414) is 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one.
What is the SMILES notation for 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one?
The canonical SMILES for 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one is CC(C)c1cccc2nc3c(c([Si](C)(C)C)c12)Cn1c-3cccc1=O.
What is the InChIKey of 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one?
The InChIKey is NGSSXOWPPRNPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2OSi/c1-13(2)14-8-6-9-16-19(14)21(25(3,4)5)15-12-23-17(20(15)22-16)10-7-11-18(23)24/h6-11,13H,12H2,1-5H3.
What are the key properties of 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one?
1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one has a molecular weight of 348.52 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-12-trimethylsilyl-11H-indolizino[1,2-b]quinolin-9-one is sourced from PubChem (CID 5459414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).