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'}

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Related Compounds

N-(2,6-dimethylergoline-8-yl)-2,2-dimethylpropanamide
CID 148841
Rosettacin
CID 24813913
N-(5,7-Dimethyl-4,6,6a,7,8,9,10,10a-octahydro-indolo[4,3-fg]quinolin-9-yl)-2,2-dimethyl-propionamide
CID 22849991
Indolizino(1,2-b)quinolin-9(11H)-one
CID 98589
1-(8-Methyl-1,2,3a,4,5,6-hexahydro-pyrazino[3,2,1-jk]carbazol-3-yl)-ethanone
CID 2829167
1-Methyl-5-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]quinolin-2-one
CID 24804775
1-(6,8-Dimethyl-2,3-dihydropyrrolo[2,3-g]quinolin-1-yl)ethanone
CID 901734
Eburnamenine-14-carboxamide, N-ethyl-
CID 162659077
2,3-dimethyl-1-((4-phenyl-1-piperazinyl)acetyl)-1H-indole
CID 802435
1-(2,3-Dimethyl-1-indolyl)-2-(4-methyl-1-piperidinyl)ethanone
CID 920008
3-acetyl-8-methyl-2,3-dihydro-1H-pyrazino[3,2,1-jk]carbazole
CID 1736277
2,3-Dihydroindol-1-yl-(2-methylquinolin-4-yl)methanone
CID 2078228

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).