N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide

C18H29NO2Si — CID 154719744

IUPACN-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide
SMILESCC(C)(C)[Si](C)(C)OCCC/C=C\NC(=O)c1ccccc1
InChIInChI=1S/C18H29NO2Si/c1-18(2,3)22(4,5)21-15-11-7-10-14-19-17(20)16-12-8-6-9-13-16/h6,8-10,12-14H,7,11,15H2,1-5H3,(H,19,20)/b14-10-
InChIKeyMMHCICKKXBEBIO-UVTDQMKNSA-N
MW319.52 g/mol
LogP4.73
Rot. Bonds7

About N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide

N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide (PubChem CID 154719744) has the molecular formula C18H29NO2Si and a molecular weight of 319.52 g/mol. Its IUPAC name is N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide.

Molecular Properties

Compound NameN-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide
PubChem CID154719744
Molecular FormulaC18H29NO2Si
Molecular Weight319.52 g/mol
Exact Mass319.20
IUPAC NameN-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide
SMILESCC(C)(C)[Si](C)(C)OCCC/C=C\NC(=O)c1ccccc1
InChIInChI=1S/C18H29NO2Si/c1-18(2,3)22(4,5)21-15-11-7-10-14-19-17(20)16-12-8-6-9-13-16/h6,8-10,12-14H,7,11,15H2,1-5H3,(H,19,20)/b14-10-
InChIKeyMMHCICKKXBEBIO-UVTDQMKNSA-N
XLogP4.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.52
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-hept-1-enyl]benzamide
CID 6917534
N-[(E)-dec-1-enyl]benzamide
CID 71501503
N-[(E)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enoyl]benzamide
CID 11324648
methyl 2-benzamido-4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutanoate
CID 102407675
N'-[2-[4-[tert-butyl(dimethyl)silyl]oxybutyl]cyclopentyl]benzohydrazide
CID 85242696
1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-3-(2-phenylethyl)urea
CID 155933037
ethyl 4-[(E)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzoate
CID 135008103
tert-butyl-dimethyl-[(E)-8-(2-phenyl-1-benzofuran-6-yl)oct-4-enoxy]silane
CID 154601605
3-[tert-butyl(dimethyl)silyl]oxypropyl N-phenylcarbamate
CID 177244740
(E)-11-[tert-butyl(dimethyl)silyl]oxyundec-2-enoic acid
CID 87313123
N-(3,3-dimethylbut-1-enyl)benzamide
CID 134831914
tert-butyl-[(E)-hex-4-enoxy]-dimethylsilane
CID 15936622

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide?
The IUPAC name of N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide (CID 154719744) is N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide.
What is the SMILES notation for N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide?
The canonical SMILES for N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide is CC(C)(C)[Si](C)(C)OCCC/C=C\NC(=O)c1ccccc1.
What is the InChIKey of N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide?
The InChIKey is MMHCICKKXBEBIO-UVTDQMKNSA-N. The full InChI is InChI=1S/C18H29NO2Si/c1-18(2,3)22(4,5)21-15-11-7-10-14-19-17(20)16-12-8-6-9-13-16/h6,8-10,12-14H,7,11,15H2,1-5H3,(H,19,20)/b14-10-.
What are the key properties of N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide?
N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide has a molecular weight of 319.52 g/mol, XLogP of 4.73, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-5-[tert-butyl(dimethyl)silyl]oxypent-1-enyl]benzamide is sourced from PubChem (CID 154719744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).