(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide

C22H29NO2Si — CID 11440040

IUPAC(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide
SMILESCCN(CC)C(=O)/C(=C\c1ccccc1)c1cccc([Si](C)(C)C)c1O
InChIInChI=1S/C22H29NO2Si/c1-6-23(7-2)22(25)19(16-17-12-9-8-10-13-17)18-14-11-15-20(21(18)24)26(3,4)5/h8-16,24H,6-7H2,1-5H3/b19-16-
InChIKeyMVAQWRYOXKFYQB-MNDPQUGUSA-N
MW367.57 g/mol
LogP4.35
Rot. Bonds6

About (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide

(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide (PubChem CID 11440040) has the molecular formula C22H29NO2Si and a molecular weight of 367.57 g/mol. Its IUPAC name is (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide.

Molecular Properties

Compound Name(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide
PubChem CID11440040
Molecular FormulaC22H29NO2Si
Molecular Weight367.57 g/mol
Exact Mass367.20
IUPAC Name(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide
SMILESCCN(CC)C(=O)/C(=C\c1ccccc1)c1cccc([Si](C)(C)C)c1O
InChIInChI=1S/C22H29NO2Si/c1-6-23(7-2)22(25)19(16-17-12-9-8-10-13-17)18-14-11-15-20(21(18)24)26(3,4)5/h8-16,24H,6-7H2,1-5H3/b19-16-
InChIKeyMVAQWRYOXKFYQB-MNDPQUGUSA-N
XLogP4.35
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.57
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide?
The IUPAC name of (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide (CID 11440040) is (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide.
What is the SMILES notation for (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide?
The canonical SMILES for (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide is CCN(CC)C(=O)/C(=C\c1ccccc1)c1cccc([Si](C)(C)C)c1O.
What is the InChIKey of (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide?
The InChIKey is MVAQWRYOXKFYQB-MNDPQUGUSA-N. The full InChI is InChI=1S/C22H29NO2Si/c1-6-23(7-2)22(25)19(16-17-12-9-8-10-13-17)18-14-11-15-20(21(18)24)26(3,4)5/h8-16,24H,6-7H2,1-5H3/b19-16-.
What are the key properties of (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide?
(Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide has a molecular weight of 367.57 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N-diethyl-2-(2-hydroxy-3-trimethylsilylphenyl)-3-phenylprop-2-enamide is sourced from PubChem (CID 11440040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).