1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one

C21H23NOSi — CID 101476717

IUPAC1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one
SMILESC=C(C)c1c([Si](C)(C)C)c(=O)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C21H23NOSi/c1-15(2)19-21(24(3,4)5)20(23)17-13-9-10-14-18(17)22(19)16-11-7-6-8-12-16/h6-14H,1H2,2-5H3
InChIKeyAUANGGQXZGVSLQ-UHFFFAOYSA-N
MW333.51 g/mol
LogP4.57
Rot. Bonds3

About 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one

1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one (PubChem CID 101476717) has the molecular formula C21H23NOSi and a molecular weight of 333.51 g/mol. Its IUPAC name is 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one.

Molecular Properties

Compound Name1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one
PubChem CID101476717
Molecular FormulaC21H23NOSi
Molecular Weight333.51 g/mol
Exact Mass333.15
IUPAC Name1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one
SMILESC=C(C)c1c([Si](C)(C)C)c(=O)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C21H23NOSi/c1-15(2)19-21(24(3,4)5)20(23)17-13-9-10-14-18(17)22(19)16-11-7-6-8-12-16/h6-14H,1H2,2-5H3
InChIKeyAUANGGQXZGVSLQ-UHFFFAOYSA-N
XLogP4.57
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.51
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-bromo-1-phenylindole-2-carboxylic acid
CID 102533933
5,7-diphenylquinolino[3,2-b]acridine-12,14-dione
CID 146333918
10-[4-[2-[4-[2-(4-carbazol-9-ylphenyl)ethenyl]phenyl]ethenyl]phenyl]acridin-9-one
CID 91612597
3,19-diphenyl-3,19-diazahexacyclo[16.8.0.02,11.04,9.012,17.020,25]hexacosa-1(18),2(11),4,6,8,12,14,16,20,22,24-undecaene-10,26-dione
CID 146334080
9-phenyl-14-prop-1-en-2-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 142355826
ethane;10-phenylacridin-9-one;thioxanthen-9-one;xanthen-9-one
CID 161285651
4-(2-oxo-1-phenylquinolin-4-yl)-1-phenylquinolin-2-one
CID 11503080
4-phenacylsulfanyl-1-phenylquinazolin-2-one
CID 2329465
3-(2-acetylsulfanylethyl)-1-phenylindole-2-carboxylic acid
CID 87917908
(4-carbazol-9-ylphenyl)-(4-ethenylphenyl)-dimethylsilane
CID 59489115
3-ethyl-4-hydroxy-1-phenylquinolin-2-one
CID 54677985
10-[(E)-2-methyl-3-phenylprop-2-enoyl]acridin-9-one
CID 11046060

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one?
The IUPAC name of 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one (CID 101476717) is 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one.
What is the SMILES notation for 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one?
The canonical SMILES for 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one is C=C(C)c1c([Si](C)(C)C)c(=O)c2ccccc2n1-c1ccccc1.
What is the InChIKey of 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one?
The InChIKey is AUANGGQXZGVSLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NOSi/c1-15(2)19-21(24(3,4)5)20(23)17-13-9-10-14-18(17)22(19)16-11-7-6-8-12-16/h6-14H,1H2,2-5H3.
What are the key properties of 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one?
1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one has a molecular weight of 333.51 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-prop-1-en-2-yl-3-trimethylsilylquinolin-4-one is sourced from PubChem (CID 101476717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).