5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide

C23H33NO3Si — CID 25269714

IUPAC5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide
SMILESCON(C)C(=O)CCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H33NO3Si/c1-23(2,3)28(20-14-8-6-9-15-20,21-16-10-7-11-17-21)27-19-13-12-18-22(25)24(4)26-5/h6-11,14-17H,12-13,18-19H2,1-5H3
InChIKeyBRCPICHSVICNHB-UHFFFAOYSA-N
MW399.61 g/mol
LogP3.75
Rot. Bonds9

About 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide

5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide (PubChem CID 25269714) has the molecular formula C23H33NO3Si and a molecular weight of 399.61 g/mol. Its IUPAC name is 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide.

Molecular Properties

Compound Name5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide
PubChem CID25269714
Molecular FormulaC23H33NO3Si
Molecular Weight399.61 g/mol
Exact Mass399.22
IUPAC Name5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide
SMILESCON(C)C(=O)CCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C23H33NO3Si/c1-23(2,3)28(20-14-8-6-9-15-20,21-16-10-7-11-17-21)27-19-13-12-18-22(25)24(4)26-5/h6-11,14-17H,12-13,18-19H2,1-5H3
InChIKeyBRCPICHSVICNHB-UHFFFAOYSA-N
XLogP3.75
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.61
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide?
The IUPAC name of 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide (CID 25269714) is 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide.
What is the SMILES notation for 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide?
The canonical SMILES for 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide is CON(C)C(=O)CCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide?
The InChIKey is BRCPICHSVICNHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33NO3Si/c1-23(2,3)28(20-14-8-6-9-15-20,21-16-10-7-11-17-21)27-19-13-12-18-22(25)24(4)26-5/h6-11,14-17H,12-13,18-19H2,1-5H3.
What are the key properties of 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide?
5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide has a molecular weight of 399.61 g/mol, XLogP of 3.75, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide is sourced from PubChem (CID 25269714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).