N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine

C15H22FNSi — CID 13179376

IUPACN-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine
SMILESCC(=C=N[Si](C)(C)C(C)(C)C)c1ccc(F)cc1
InChIInChI=1S/C15H22FNSi/c1-12(13-7-9-14(16)10-8-13)11-17-18(5,6)15(2,3)4/h7-10H,1-6H3
InChIKeyBMKPSYOCNMJUES-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.90
Rot. Bonds2

About N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine

N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine (PubChem CID 13179376) has the molecular formula C15H22FNSi and a molecular weight of 263.43 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine.

Molecular Properties

Compound NameN-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine
PubChem CID13179376
Molecular FormulaC15H22FNSi
Molecular Weight263.43 g/mol
Exact Mass263.15
IUPAC NameN-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine
SMILESCC(=C=N[Si](C)(C)C(C)(C)C)c1ccc(F)cc1
InChIInChI=1S/C15H22FNSi/c1-12(13-7-9-14(16)10-8-13)11-17-18(5,6)15(2,3)4/h7-10H,1-6H3
InChIKeyBMKPSYOCNMJUES-UHFFFAOYSA-N
XLogP4.90
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine
CID 122229684
N-[tert-butyl(dimethyl)silyl]-2-cyclopentyl-2-phenylethenimine
CID 11277974
N'-tert-butyl-4-fluorobenzohydrazide
CID 15617766
1-(4-fluorophenyl)ethenylsilane
CID 175020263
2-(4-fluorophenyl)propan-2-ol
CID 637733
1,2-bis(4-fluorophenyl)-2-methylpropan-1-one
CID 64757736
N-[(Z)-1-(4-tert-butylphenyl)ethylideneamino]-4-fluorobenzamide
CID 6183873
1-fluoro-4-[2-(4-fluorophenyl)propan-2-yl]benzene
CID 22572271
4-fluoro-N-(propan-2-ylideneamino)benzamide
CID 847533
2-bromo-1-(4-fluorophenyl)-2-methylpropan-1-one
CID 13113175
2-(4-fluorophenyl)-2-hydroxypropanenitrile
CID 57349674
1-(4-fluorophenyl)ethanone;methanol
CID 160697688

Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine?
The IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine (CID 13179376) is N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine.
What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine?
The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine is CC(=C=N[Si](C)(C)C(C)(C)C)c1ccc(F)cc1.
What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine?
The InChIKey is BMKPSYOCNMJUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNSi/c1-12(13-7-9-14(16)10-8-13)11-17-18(5,6)15(2,3)4/h7-10H,1-6H3.
What are the key properties of N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine?
N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine has a molecular weight of 263.43 g/mol, XLogP of 4.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethyl)silyl]-2-(4-fluorophenyl)prop-1-en-1-imine is sourced from PubChem (CID 13179376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).