2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide

C30H34N2OSi — CID 177432131

IUPAC2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide
SMILESCC[Si](CC)(CC)CCc1cccc(-c2ccccc2)c1C(=O)Nc1cccc2cccnc12
InChIInChI=1S/C30H34N2OSi/c1-4-34(5-2,6-3)22-20-24-15-10-18-26(23-13-8-7-9-14-23)28(24)30(33)32-27-19-11-16-25-17-12-21-31-29(25)27/h7-19,21H,4-6,20,22H2,1-3H3,(H,32,33)
InChIKeyZMEFVQGNFXYBBQ-UHFFFAOYSA-N
MW466.70 g/mol
LogP8.21
Rot. Bonds9

About 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide

2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide (PubChem CID 177432131) has the molecular formula C30H34N2OSi and a molecular weight of 466.70 g/mol. Its IUPAC name is 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide.

Molecular Properties

Compound Name2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide
PubChem CID177432131
Molecular FormulaC30H34N2OSi
Molecular Weight466.70 g/mol
Exact Mass466.24
IUPAC Name2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide
SMILESCC[Si](CC)(CC)CCc1cccc(-c2ccccc2)c1C(=O)Nc1cccc2cccnc12
InChIInChI=1S/C30H34N2OSi/c1-4-34(5-2,6-3)22-20-24-15-10-18-26(23-13-8-7-9-14-23)28(24)30(33)32-27-19-11-16-25-17-12-21-31-29(25)27/h7-19,21H,4-6,20,22H2,1-3H3,(H,32,33)
InChIKeyZMEFVQGNFXYBBQ-UHFFFAOYSA-N
XLogP8.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.70
LogP ≤ 58.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-fluoro-N-quinolin-8-yl-2,6-bis(2-triethylsilylethyl)benzamide
CID 177414845
2,6-bis(4-methoxyphenyl)-N-quinolin-8-ylbenzamide
CID 139200312
2-[(E)-pent-2-enyl]-N-quinolin-8-yl-6-(trifluoromethyl)benzamide
CID 132547082
2-methyl-N-quinolin-8-ylnaphthalene-1-carboxamide
CID 132837940
2-ethyl-3-oxo-5,6-diphenyl-N-quinolin-8-ylpyridazine-4-carboxamide
CID 108790850
1-propyl-3-quinolin-8-ylurea
CID 13078451
2-(aminomethyl)-N-quinolin-8-ylbenzamide
CID 82546402
5-methyl-2-(2-phenylethyl)-N-quinolin-8-ylbenzamide
CID 102133728
2,4-dimethyl-6-oxo-N-quinolin-8-ylpyran-3-carboxamide
CID 110699363
N-[2-(hydroxymethyl)phenyl]quinoline-8-carboxamide
CID 61497887
6-N,6-N-diethyl-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109099049
2-methyl-5-phenyl-N-quinolin-8-ylpentanamide
CID 175900489

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide?
The IUPAC name of 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide (CID 177432131) is 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide.
What is the SMILES notation for 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide?
The canonical SMILES for 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide is CC[Si](CC)(CC)CCc1cccc(-c2ccccc2)c1C(=O)Nc1cccc2cccnc12.
What is the InChIKey of 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide?
The InChIKey is ZMEFVQGNFXYBBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H34N2OSi/c1-4-34(5-2,6-3)22-20-24-15-10-18-26(23-13-8-7-9-14-23)28(24)30(33)32-27-19-11-16-25-17-12-21-31-29(25)27/h7-19,21H,4-6,20,22H2,1-3H3,(H,32,33).
What are the key properties of 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide?
2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide has a molecular weight of 466.70 g/mol, XLogP of 8.21, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-quinolin-8-yl-6-(2-triethylsilylethyl)benzamide is sourced from PubChem (CID 177432131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).