trimethyl-[17-(silylmethylamino)heptadecyl]azanium

C21H49N2Si+ — CID 157156405

IUPACtrimethyl-[17-(silylmethylamino)heptadecyl]azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCCCNC[SiH3]
InChIInChI=1S/C21H49N2Si/c1-23(2,3)20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-22-21-24/h22H,4-21H2,1-3,24H3/q+1
InChIKeyLCPYGXLXYGLOPO-UHFFFAOYSA-N
MW357.72 g/mol
LogP4.46
Rot. Bonds19

About trimethyl-[17-(silylmethylamino)heptadecyl]azanium

trimethyl-[17-(silylmethylamino)heptadecyl]azanium (PubChem CID 157156405) has the molecular formula C21H49N2Si+ and a molecular weight of 357.72 g/mol. Its IUPAC name is trimethyl-[17-(silylmethylamino)heptadecyl]azanium.

Molecular Properties

Compound Nametrimethyl-[17-(silylmethylamino)heptadecyl]azanium
PubChem CID157156405
Molecular FormulaC21H49N2Si+
Molecular Weight357.72 g/mol
Exact Mass357.37
IUPAC Nametrimethyl-[17-(silylmethylamino)heptadecyl]azanium
SMILESC[N+](C)(C)CCCCCCCCCCCCCCCCCNC[SiH3]
InChIInChI=1S/C21H49N2Si/c1-23(2,3)20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-22-21-24/h22H,4-21H2,1-3,24H3/q+1
InChIKeyLCPYGXLXYGLOPO-UHFFFAOYSA-N
XLogP4.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.72
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[17-(silylmethylamino)heptadecyl]azanium?
The IUPAC name of trimethyl-[17-(silylmethylamino)heptadecyl]azanium (CID 157156405) is trimethyl-[17-(silylmethylamino)heptadecyl]azanium.
What is the SMILES notation for trimethyl-[17-(silylmethylamino)heptadecyl]azanium?
The canonical SMILES for trimethyl-[17-(silylmethylamino)heptadecyl]azanium is C[N+](C)(C)CCCCCCCCCCCCCCCCCNC[SiH3].
What is the InChIKey of trimethyl-[17-(silylmethylamino)heptadecyl]azanium?
The InChIKey is LCPYGXLXYGLOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H49N2Si/c1-23(2,3)20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-22-21-24/h22H,4-21H2,1-3,24H3/q+1.
What are the key properties of trimethyl-[17-(silylmethylamino)heptadecyl]azanium?
trimethyl-[17-(silylmethylamino)heptadecyl]azanium has a molecular weight of 357.72 g/mol, XLogP of 4.46, 19 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[17-(silylmethylamino)heptadecyl]azanium is sourced from PubChem (CID 157156405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).