(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide

C31H31NO2Si — CID 146036627

IUPAC(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide
SMILESCC(C)(C)NC(=O)/C(=C/c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H31NO2Si/c1-31(2,3)32-30(33)29(24-25-16-8-4-9-17-25)34-35(26-18-10-5-11-19-26,27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-24H,1-3H3,(H,32,33)/b29-24-
InChIKeyUSAMFKIBYCDLQB-OLFWJLLRSA-N
MW477.68 g/mol
LogP4.63
Rot. Bonds7

About (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide

(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide (PubChem CID 146036627) has the molecular formula C31H31NO2Si and a molecular weight of 477.68 g/mol. Its IUPAC name is (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide.

Molecular Properties

Compound Name(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide
PubChem CID146036627
Molecular FormulaC31H31NO2Si
Molecular Weight477.68 g/mol
Exact Mass477.21
IUPAC Name(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide
SMILESCC(C)(C)NC(=O)/C(=C/c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H31NO2Si/c1-31(2,3)32-30(33)29(24-25-16-8-4-9-17-25)34-35(26-18-10-5-11-19-26,27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-24H,1-3H3,(H,32,33)/b29-24-
InChIKeyUSAMFKIBYCDLQB-OLFWJLLRSA-N
XLogP4.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.68
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(z)-N-cyclohexyl-3-phenyl-2-[(triphenylsilyl)oxy]acrylamide
CID 146036672
(z)-N-(2,2-dimethoxyethyl)-3-phenyl-2-[(triphenylsilyl)-oxy]acrylamide
CID 146036673

Frequently Asked Questions

What is the IUPAC name of (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide?
The IUPAC name of (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide (CID 146036627) is (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide.
What is the SMILES notation for (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide?
The canonical SMILES for (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide is CC(C)(C)NC(=O)/C(=C/c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide?
The InChIKey is USAMFKIBYCDLQB-OLFWJLLRSA-N. The full InChI is InChI=1S/C31H31NO2Si/c1-31(2,3)32-30(33)29(24-25-16-8-4-9-17-25)34-35(26-18-10-5-11-19-26,27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-24H,1-3H3,(H,32,33)/b29-24-.
What are the key properties of (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide?
(Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide has a molecular weight of 477.68 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-tert-butyl-3-phenyl-2-triphenylsilyloxyprop-2-enamide is sourced from PubChem (CID 146036627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).