N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide

C24H28N2O2Si — CID 152730332

IUPACN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(NC(=O)c2ccccc2-c2ccccc2)nc1
InChIInChI=1S/C24H28N2O2Si/c1-24(2,3)29(4,5)28-19-15-16-22(25-17-19)26-23(27)21-14-10-9-13-20(21)18-11-7-6-8-12-18/h6-17H,1-5H3,(H,25,26,27)
InChIKeyZXMCPVVIBFGQKH-UHFFFAOYSA-N
MW404.59 g/mol
LogP6.38
Rot. Bonds5

About N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide

N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide (PubChem CID 152730332) has the molecular formula C24H28N2O2Si and a molecular weight of 404.59 g/mol. Its IUPAC name is N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide
PubChem CID152730332
Molecular FormulaC24H28N2O2Si
Molecular Weight404.59 g/mol
Exact Mass404.19
IUPAC NameN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(NC(=O)c2ccccc2-c2ccccc2)nc1
InChIInChI=1S/C24H28N2O2Si/c1-24(2,3)29(4,5)28-19-15-16-22(25-17-19)26-23(27)21-14-10-9-13-20(21)18-11-7-6-8-12-18/h6-17H,1-5H3,(H,25,26,27)
InChIKeyZXMCPVVIBFGQKH-UHFFFAOYSA-N
XLogP6.38
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.59
LogP ≤ 56.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide?
The IUPAC name of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide (CID 152730332) is N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide.
What is the SMILES notation for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide?
The canonical SMILES for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide is CC(C)(C)[Si](C)(C)Oc1ccc(NC(=O)c2ccccc2-c2ccccc2)nc1.
What is the InChIKey of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide?
The InChIKey is ZXMCPVVIBFGQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2Si/c1-24(2,3)29(4,5)28-19-15-16-22(25-17-19)26-23(27)21-14-10-9-13-20(21)18-11-7-6-8-12-18/h6-17H,1-5H3,(H,25,26,27).
What are the key properties of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide?
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide has a molecular weight of 404.59 g/mol, XLogP of 6.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-phenylbenzamide is sourced from PubChem (CID 152730332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).