trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane

C18H30N2OSi — CID 171291672

IUPACtrimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane
SMILESC=CCC[C@H](c1ccc(O[Si](C)(C)C)cc1)N1CCNCC1
InChIInChI=1S/C18H30N2OSi/c1-5-6-7-18(20-14-12-19-13-15-20)16-8-10-17(11-9-16)21-22(2,3)4/h5,8-11,18-19H,1,6-7,12-15H2,2-4H3/t18-/m1/s1
InChIKeyLEOPWMQLZDGDFN-GOSISDBHSA-N
MW318.54 g/mol
LogP3.81
Rot. Bonds7

About trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane

trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane (PubChem CID 171291672) has the molecular formula C18H30N2OSi and a molecular weight of 318.54 g/mol. Its IUPAC name is trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane.

Molecular Properties

Compound Nametrimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane
PubChem CID171291672
Molecular FormulaC18H30N2OSi
Molecular Weight318.54 g/mol
Exact Mass318.21
IUPAC Nametrimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane
SMILESC=CCC[C@H](c1ccc(O[Si](C)(C)C)cc1)N1CCNCC1
InChIInChI=1S/C18H30N2OSi/c1-5-6-7-18(20-14-12-19-13-15-20)16-8-10-17(11-9-16)21-22(2,3)4/h5,8-11,18-19H,1,6-7,12-15H2,2-4H3/t18-/m1/s1
InChIKeyLEOPWMQLZDGDFN-GOSISDBHSA-N
XLogP3.81
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.54
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[4-[(1S)-1-piperazin-1-ylbutyl]phenoxy]silane
CID 171279039
trimethyl-[4-[(1R)-4-methyl-1-piperazin-1-ylpentyl]phenoxy]silane
CID 171311005
[4-[(1S)-2-fluoro-1-piperazin-1-ylethyl]phenoxy]-trimethylsilane;dihydrochloride
CID 171291647
1-[(1R)-1-[4-(trifluoromethoxy)phenyl]pent-4-enyl]piperazine
CID 171291836
1-[(1S)-1-[4-(trifluoromethoxy)phenyl]pent-4-enyl]piperazine
CID 171279214
[4-[(1S)-1-piperazin-1-ylpent-4-enyl]phenyl] acetate;dihydrochloride
CID 171280300
trimethyl-[4-[(1R)-3-methyl-1-piperazin-1-ylbutyl]phenoxy]silane
CID 171291668
1-[(1S)-1-(4-bromophenyl)pent-4-enyl]piperazine
CID 171273720
[4-[(1S)-2-cyclopropyl-1-piperazin-1-ylethyl]phenoxy]-trimethylsilane;dihydrochloride
CID 171279042
trimethyl-[4-[(1R)-1-piperazin-1-ylprop-2-enyl]phenoxy]silane;dihydrochloride
CID 171291643
1-[(1S)-1-[4-(difluoromethoxy)phenyl]hept-6-enyl]piperazine
CID 171165023
1-[(1S)-1-(5-methylfuran-2-yl)pent-4-enyl]piperazine
CID 171281728

Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane?
The IUPAC name of trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane (CID 171291672) is trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane.
What is the SMILES notation for trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane?
The canonical SMILES for trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane is C=CCC[C@H](c1ccc(O[Si](C)(C)C)cc1)N1CCNCC1.
What is the InChIKey of trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane?
The InChIKey is LEOPWMQLZDGDFN-GOSISDBHSA-N. The full InChI is InChI=1S/C18H30N2OSi/c1-5-6-7-18(20-14-12-19-13-15-20)16-8-10-17(11-9-16)21-22(2,3)4/h5,8-11,18-19H,1,6-7,12-15H2,2-4H3/t18-/m1/s1.
What are the key properties of trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane?
trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane has a molecular weight of 318.54 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[(1R)-1-piperazin-1-ylpent-4-enyl]phenoxy]silane is sourced from PubChem (CID 171291672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).