trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane

C20H46N2O3Si2 — CID 23150084

IUPACtrimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
SMILESCO[Si](CC(C)CN1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1)(OC)OC
InChIInChI=1S/C20H46N2O3Si2/c1-17(2)27(18(3)4,19(5)6)22-13-11-21(12-14-22)15-20(7)16-26(23-8,24-9)25-10/h17-20H,11-16H2,1-10H3
InChIKeyNBROELFRVDDQPH-UHFFFAOYSA-N
MW418.77 g/mol
LogP4.29
Rot. Bonds11

About trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane

trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane (PubChem CID 23150084) has the molecular formula C20H46N2O3Si2 and a molecular weight of 418.77 g/mol. Its IUPAC name is trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane.

Molecular Properties

Compound Nametrimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
PubChem CID23150084
Molecular FormulaC20H46N2O3Si2
Molecular Weight418.77 g/mol
Exact Mass418.30
IUPAC Nametrimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
SMILESCO[Si](CC(C)CN1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1)(OC)OC
InChIInChI=1S/C20H46N2O3Si2/c1-17(2)27(18(3)4,19(5)6)22-13-11-21(12-14-22)15-20(7)16-26(23-8,24-9)25-10/h17-20H,11-16H2,1-10H3
InChIKeyNBROELFRVDDQPH-UHFFFAOYSA-N
XLogP4.29
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.77
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-methyl-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
CID 23150069
triethoxy-[3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
CID 23150171
triethoxy-(2-methyl-3-piperazin-1-ylpropyl)silane
CID 23150078
diethoxy-methyl-[2-[4-tri(propan-2-yl)silylpiperazin-1-yl]ethyl]silane
CID 23150092
1-[(2R)-3-iodo-2-methylpropyl]aziridine
CID 163538193
trimethyl-(2-methyl-3-morpholin-4-ylpropyl)silane
CID 10488877
trimethoxy-[2-(4-trimethylsilylpiperazin-1-yl)ethyl]silane
CID 23150073
[4-(4-dipropoxysilylbutyl)piperazin-1-yl]-tri(propan-2-yl)silane
CID 123388378
1-methyl-4-[(2S)-2-methylbutyl]piperazine
CID 130224614
2-(aziridin-1-yl)ethane-1,1-diol
CID 19973688
2,2-difluoroethyl(trimethoxy)silane
CID 87720096
1-[4,7-bis(2-hydroxypropyl)-1,4,7-triazonan-1-yl]propan-2-ol
CID 4961557

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane?
The IUPAC name of trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane (CID 23150084) is trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane.
What is the SMILES notation for trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane?
The canonical SMILES for trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane is CO[Si](CC(C)CN1CCN([Si](C(C)C)(C(C)C)C(C)C)CC1)(OC)OC.
What is the InChIKey of trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane?
The InChIKey is NBROELFRVDDQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46N2O3Si2/c1-17(2)27(18(3)4,19(5)6)22-13-11-21(12-14-22)15-20(7)16-26(23-8,24-9)25-10/h17-20H,11-16H2,1-10H3.
What are the key properties of trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane?
trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane has a molecular weight of 418.77 g/mol, XLogP of 4.29, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[2-methyl-3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane is sourced from PubChem (CID 23150084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).