4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide

C20H25NO5Si — CID 58554755

IUPAC4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide
SMILESCO[Si](CCCNC(=O)c1ccc(C(=O)c2ccccc2)cc1)(OC)OC
InChIInChI=1S/C20H25NO5Si/c1-24-27(25-2,26-3)15-7-14-21-20(23)18-12-10-17(11-13-18)19(22)16-8-5-4-6-9-16/h4-6,8-13H,7,14-15H2,1-3H3,(H,21,23)
InChIKeyHUYVVCPLJXLJCJ-UHFFFAOYSA-N
MW387.51 g/mol
LogP2.92
Rot. Bonds10

About 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide

4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide (PubChem CID 58554755) has the molecular formula C20H25NO5Si and a molecular weight of 387.51 g/mol. Its IUPAC name is 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide.

Molecular Properties

Compound Name4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide
PubChem CID58554755
Molecular FormulaC20H25NO5Si
Molecular Weight387.51 g/mol
Exact Mass387.15
IUPAC Name4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide
SMILESCO[Si](CCCNC(=O)c1ccc(C(=O)c2ccccc2)cc1)(OC)OC
InChIInChI=1S/C20H25NO5Si/c1-24-27(25-2,26-3)15-7-14-21-20(23)18-12-10-17(11-13-18)19(22)16-8-5-4-6-9-16/h4-6,8-13H,7,14-15H2,1-3H3,(H,21,23)
InChIKeyHUYVVCPLJXLJCJ-UHFFFAOYSA-N
XLogP2.92
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.51
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-azido-2,3,5,6-tetrafluoro-N-(3-trimethoxysilylpropyl)benzamide;4-azido-N-(3-trimethoxysilylpropyl)benzamide;4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide
CID 159843457
phenyl-[3-[(3-trimethoxysilylpropylamino)methyl]phenyl]methanone
CID 176549486
N-(3-trimethoxysilylpropyl)-4-(10,15,20-triphenyl-21,22,23,24-tetrahydroporphyrin-5-yl)benzamide
CID 123343562
methyl 4-benzamidobutanoate
CID 13197711
1-phenyl-3-(3-trimethoxysilylpropylamino)propan-1-one
CID 156782996
2-[3-[ethoxy(dimethoxy)silyl]propylcarbamoyl]benzoic acid
CID 174032259
4-(propan-2-yldiazenyl)-N-(3-trimethoxysilylpropyl)benzamide
CID 123877140
trimethylsilyl 4-benzamidobutanoate
CID 10802651
N-(4-oxopentyl)benzamide
CID 10798281
N-(2-aminoethyl)benzamide;ethane
CID 143976252
2-benzoyl-N-(3-methoxypropyl)benzamide
CID 11841231
methyl 4-(3-phenylpropylcarbamoyl)benzoate
CID 27646995

Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide?
The IUPAC name of 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide (CID 58554755) is 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide.
What is the SMILES notation for 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide?
The canonical SMILES for 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide is CO[Si](CCCNC(=O)c1ccc(C(=O)c2ccccc2)cc1)(OC)OC.
What is the InChIKey of 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide?
The InChIKey is HUYVVCPLJXLJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO5Si/c1-24-27(25-2,26-3)15-7-14-21-20(23)18-12-10-17(11-13-18)19(22)16-8-5-4-6-9-16/h4-6,8-13H,7,14-15H2,1-3H3,(H,21,23).
What are the key properties of 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide?
4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide has a molecular weight of 387.51 g/mol, XLogP of 2.92, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-(3-trimethoxysilylpropyl)benzamide is sourced from PubChem (CID 58554755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).