6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide

C25H32N2OSi — CID 163364527

IUPAC6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide
SMILESC[Si](C)(C)CC(CCCc1ccccc1)CC(=O)Nc1cccc2cccnc12
InChIInChI=1S/C25H32N2OSi/c1-29(2,3)19-21(13-7-12-20-10-5-4-6-11-20)18-24(28)27-23-16-8-14-22-15-9-17-26-25(22)23/h4-6,8-11,14-17,21H,7,12-13,18-19H2,1-3H3,(H,27,28)
InChIKeyRCLQWIDSBXSDLU-UHFFFAOYSA-N
MW404.63 g/mol
LogP6.54
Rot. Bonds9

About 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide

6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide (PubChem CID 163364527) has the molecular formula C25H32N2OSi and a molecular weight of 404.63 g/mol. Its IUPAC name is 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide.

Molecular Properties

Compound Name6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide
PubChem CID163364527
Molecular FormulaC25H32N2OSi
Molecular Weight404.63 g/mol
Exact Mass404.23
IUPAC Name6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide
SMILESC[Si](C)(C)CC(CCCc1ccccc1)CC(=O)Nc1cccc2cccnc12
InChIInChI=1S/C25H32N2OSi/c1-29(2,3)19-21(13-7-12-20-10-5-4-6-11-20)18-24(28)27-23-16-8-14-22-15-9-17-26-25(22)23/h4-6,8-11,14-17,21H,7,12-13,18-19H2,1-3H3,(H,27,28)
InChIKeyRCLQWIDSBXSDLU-UHFFFAOYSA-N
XLogP6.54
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.63
LogP ≤ 56.54
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-benzyl-N-quinolin-8-yl-4-trimethylsilylbutanamide
CID 163364528
5-(4-bromophenyl)-3-[[dimethyl(phenyl)silyl]methyl]-N-quinolin-8-ylpentanamide
CID 163364514
2-methyl-5-phenyl-N-quinolin-8-ylpentanamide
CID 175900489
3-[[dimethyl(phenyl)silyl]methyl]-6,6,6-trifluoro-N-quinolin-8-ylhexanamide
CID 163364486
(3R)-3-methyl-4-phenyl-N-quinolin-8-ylbutanamide
CID 122231949
3-(cyanomethyl)-N-quinolin-8-ylhexanamide
CID 132516611
2,2-dimethyl-5-phenyl-N-quinolin-8-ylpentanamide
CID 132571622
3-[[dimethyl(phenyl)silyl]methyl]-6,10-dimethyl-N-quinolin-8-ylundec-9-enamide
CID 175252766
5-[dimethyl(phenyl)silyl]-4-methyl-N-quinolin-8-ylpentanamide
CID 163364489
N'-benzyl-N'-methyl-N-quinolin-8-ylpropanediamide
CID 108946174
2-[2-oxo-2-(quinolin-8-ylamino)ethyl]sulfanylacetic acid
CID 104569029
(E)-8-phenyl-4-propyl-N-quinolin-8-yloct-6-enamide
CID 155797475

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide?
The IUPAC name of 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide (CID 163364527) is 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide.
What is the SMILES notation for 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide?
The canonical SMILES for 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide is C[Si](C)(C)CC(CCCc1ccccc1)CC(=O)Nc1cccc2cccnc12.
What is the InChIKey of 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide?
The InChIKey is RCLQWIDSBXSDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N2OSi/c1-29(2,3)19-21(13-7-12-20-10-5-4-6-11-20)18-24(28)27-23-16-8-14-22-15-9-17-26-25(22)23/h4-6,8-11,14-17,21H,7,12-13,18-19H2,1-3H3,(H,27,28).
What are the key properties of 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide?
6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide has a molecular weight of 404.63 g/mol, XLogP of 6.54, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-N-quinolin-8-yl-3-(trimethylsilylmethyl)hexanamide is sourced from PubChem (CID 163364527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).