tetrakis[1-(dimethylamino)propyl] silicate

C20H48N4O4Si — CID 87448769

IUPACtetrakis[1-(dimethylamino)propyl] silicate
SMILESCCC(O[Si](OC(CC)N(C)C)(OC(CC)N(C)C)OC(CC)N(C)C)N(C)C
InChIInChI=1S/C20H48N4O4Si/c1-13-17(21(5)6)25-29(26-18(14-2)22(7)8,27-19(15-3)23(9)10)28-20(16-4)24(11)12/h17-20H,13-16H2,1-12H3
InChIKeyVHKVRYXWUWSDJN-UHFFFAOYSA-N
MW436.71 g/mol
LogP2.68
Rot. Bonds16

About tetrakis[1-(dimethylamino)propyl] silicate

tetrakis[1-(dimethylamino)propyl] silicate (PubChem CID 87448769) has the molecular formula C20H48N4O4Si and a molecular weight of 436.71 g/mol. Its IUPAC name is tetrakis[1-(dimethylamino)propyl] silicate.

Molecular Properties

Compound Nametetrakis[1-(dimethylamino)propyl] silicate
PubChem CID87448769
Molecular FormulaC20H48N4O4Si
Molecular Weight436.71 g/mol
Exact Mass436.34
IUPAC Nametetrakis[1-(dimethylamino)propyl] silicate
SMILESCCC(O[Si](OC(CC)N(C)C)(OC(CC)N(C)C)OC(CC)N(C)C)N(C)C
InChIInChI=1S/C20H48N4O4Si/c1-13-17(21(5)6)25-29(26-18(14-2)22(7)8,27-19(15-3)23(9)10)28-20(16-4)24(11)12/h17-20H,13-16H2,1-12H3
InChIKeyVHKVRYXWUWSDJN-UHFFFAOYSA-N
XLogP2.68
TPSA49.88 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.71
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetrakis[1-(dimethylamino)propyl] silicate?
The IUPAC name of tetrakis[1-(dimethylamino)propyl] silicate (CID 87448769) is tetrakis[1-(dimethylamino)propyl] silicate.
What is the SMILES notation for tetrakis[1-(dimethylamino)propyl] silicate?
The canonical SMILES for tetrakis[1-(dimethylamino)propyl] silicate is CCC(O[Si](OC(CC)N(C)C)(OC(CC)N(C)C)OC(CC)N(C)C)N(C)C.
What is the InChIKey of tetrakis[1-(dimethylamino)propyl] silicate?
The InChIKey is VHKVRYXWUWSDJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H48N4O4Si/c1-13-17(21(5)6)25-29(26-18(14-2)22(7)8,27-19(15-3)23(9)10)28-20(16-4)24(11)12/h17-20H,13-16H2,1-12H3.
What are the key properties of tetrakis[1-(dimethylamino)propyl] silicate?
tetrakis[1-(dimethylamino)propyl] silicate has a molecular weight of 436.71 g/mol, XLogP of 2.68, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis[1-(dimethylamino)propyl] silicate is sourced from PubChem (CID 87448769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).