(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide

C26H37NO2Si — CID 10550232

IUPAC(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide
SMILESCCN(CC)C(=O)CCC/C=C\O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C26H37NO2Si/c1-6-27(7-2)25(28)21-15-10-16-22-29-30(26(3,4)5,23-17-11-8-12-18-23)24-19-13-9-14-20-24/h8-9,11-14,16-20,22H,6-7,10,15,21H2,1-5H3/b22-16-
InChIKeyWYXDFELFBAIRBA-JWGURIENSA-N
MW423.67 g/mol
LogP5.12
Rot. Bonds10

About (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide

(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide (PubChem CID 10550232) has the molecular formula C26H37NO2Si and a molecular weight of 423.67 g/mol. Its IUPAC name is (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide.

Molecular Properties

Compound Name(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide
PubChem CID10550232
Molecular FormulaC26H37NO2Si
Molecular Weight423.67 g/mol
Exact Mass423.26
IUPAC Name(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide
SMILESCCN(CC)C(=O)CCC/C=C\O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C26H37NO2Si/c1-6-27(7-2)25(28)21-15-10-16-22-29-30(26(3,4)5,23-17-11-8-12-18-23)24-19-13-9-14-20-24/h8-9,11-14,16-20,22H,6-7,10,15,21H2,1-5H3/b22-16-
InChIKeyWYXDFELFBAIRBA-JWGURIENSA-N
XLogP5.12
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.67
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-((Tert-butyldiphenylsilyl)oxy)-2-fluoro-1-(2-methylpiperidin-1-yl)propan-1-one
CID 135391124
(4S)-4-[tert-butyl(diphenyl)silyl]oxy-1-pyrrolidin-1-yloct-7-en-1-one
CID 10863293
4-[Tert-butyl(diphenyl)silyl]oxy-1-pyrrolidin-1-yloct-7-en-1-one
CID 85293305
6-[dimethyl(phenyl)silyl]-N,N-diethylhept-6-enamide
CID 86003269
[1-[2-[tert-butyl(diphenyl)silyl]oxyethyl]cyclohexa-2,5-dien-1-yl]-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 134887002
(E)-7-[dimethyl(phenyl)silyl]-N,N-diethylhept-6-enamide
CID 134999553
3-((Tert-butyldiphenylsilyl)oxy)-1-(2-methylpiperidin-1-yl)propan-1-one
CID 135391106
CID 176433657
CID 176433657
1-[1-[Tert-butyl(diphenyl)silyl]oxypropan-2-yl]pyrrolidin-2-one
CID 18318463
5-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylpentanamide
CID 25269714
1-[(2S)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]azetidin-2-one
CID 67947022
1-[1-[Tert-butyl(diphenyl)silyl]oxypropyl]azetidin-2-one
CID 67947023

Frequently Asked Questions

What is the IUPAC name of (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide?
The IUPAC name of (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide (CID 10550232) is (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide.
What is the SMILES notation for (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide?
The canonical SMILES for (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide is CCN(CC)C(=O)CCC/C=C\O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide?
The InChIKey is WYXDFELFBAIRBA-JWGURIENSA-N. The full InChI is InChI=1S/C26H37NO2Si/c1-6-27(7-2)25(28)21-15-10-16-22-29-30(26(3,4)5,23-17-11-8-12-18-23)24-19-13-9-14-20-24/h8-9,11-14,16-20,22H,6-7,10,15,21H2,1-5H3/b22-16-.
What are the key properties of (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide?
(Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide has a molecular weight of 423.67 g/mol, XLogP of 5.12, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-[tert-butyl(diphenyl)silyl]oxy-N,N-diethylhex-5-enamide is sourced from PubChem (CID 10550232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).